data_6uf2_residue ############################ # Computer software used # ############################ 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 6uf2 _Structure_validation_residue.Date_analyzed 2020-10-02 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 . . . . . 0 CA--C 1.515 -0.386 0 CA-C-O 121.992 0.901 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.76 -19.41 25.36 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.796 -178.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -72.95 -11.08 60.44 Favored 'General case' 0 C--N 1.362 1.143 0 O-C-N 121.139 -0.976 . . . . 0.0 110.671 -178.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -93.15 -6.41 47.95 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.5 mt -103.87 -114.58 0.23 Allowed 'General case' 0 C--N 1.353 0.722 0 CA-C-O 121.942 0.877 . . . . 0.0 109.102 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -89.52 158.05 46.24 Favored Pre-proline 0 C--N 1.345 0.39 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -54.82 129.0 32.81 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 120.795 0.996 . . . . 0.0 112.181 176.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.92 117.0 14.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-O 123.415 1.579 . . . . 0.0 112.631 -175.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -85.8 160.91 51.92 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -60.42 -23.6 75.33 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 121.467 1.445 . . . . 0.0 113.01 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -73.12 -47.87 40.52 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-O 122.392 1.091 . . . . 0.0 108.601 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.35 93.32 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 125.07 1.348 . . . . 0.0 110.778 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.8 t -61.56 -44.36 98.5 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.962 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.2 p -73.21 -33.42 65.36 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 119.076 -1.05 . . . . 0.0 111.671 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.44 -38.93 71.29 Favored 'General case' 0 C--N 1.361 1.07 0 O-C-N 121.272 -0.893 . . . . 0.0 110.285 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -79.54 -13.64 59.4 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 121.921 -0.487 . . . . 0.0 111.742 179.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 17.5 m -59.19 -51.81 79.02 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 120.636 -1.29 . . . . 0.0 114.121 -177.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo . . . . . 0 C--N 1.349 0.572 0 CA-C-N 121.551 1.59 . . . . 0.0 114.683 -179.753 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.9 tp -64.04 -54.68 38.19 Favored Pre-proline 0 C--N 1.361 1.104 0 O-C-N 121.326 -0.859 . . . . 0.0 112.82 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.97 -22.4 42.03 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.02 1.4 . . . . 0.0 114.506 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -70.86 -38.36 73.15 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.9 -33.49 68.37 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.46 -39.47 94.55 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 121.644 -0.66 . . . . 0.0 109.529 178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.7 m -64.07 -40.31 95.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.469 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 59.2 mt -69.04 -39.73 79.02 Favored 'General case' 0 C--N 1.361 1.077 0 CA-C-O 121.094 0.474 . . . . 0.0 110.016 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -51.78 -23.7 4.99 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 125.651 1.58 . . . . 0.0 113.408 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -66.91 -19.82 65.8 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.509 -0.744 . . . . 0.0 111.497 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 130.03 -0.69 5.74 Favored Glycine 0 C--N 1.359 1.844 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.3 m -66.64 -41.83 87.67 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 118.28 1.04 . . . . 0.0 109.515 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 m 65.72 177.91 0.21 Allowed 'General case' 0 C--N 1.375 1.678 0 CA-C-O 121.676 0.751 . . . . 0.0 110.848 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.0 mp -132.59 126.8 55.45 Favored 'Isoleucine or valine' 0 C--N 1.359 0.98 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -154.99 133.65 12.03 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.05 -170.22 43.33 Favored Glycine 0 CA--C 1.491 -1.425 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -120.69 114.45 21.69 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -91.53 129.07 37.57 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.21 123.15 27.68 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.915 1.341 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 92.7 t -107.2 116.47 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.24 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 177.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -72.33 136.69 46.27 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.589 0.709 . . . . 0.0 109.39 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.28 -8.1 62.4 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 110.277 -1.129 . . . . 0.0 110.277 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.8 -104.15 0.61 Allowed Glycine 0 C--N 1.354 1.561 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.14 159.16 21.37 Favored Pre-proline 0 N--CA 1.448 -0.562 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.7 124.01 7.88 Favored 'Trans proline' 0 CA--C 1.515 -0.466 0 C-N-CA 121.341 1.361 . . . . 0.0 112.818 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.52 136.15 45.07 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 CA-C-O 122.244 1.021 . . . . 0.0 108.927 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.8 m -65.02 141.47 58.75 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.165 0.983 . . . . 0.0 112.276 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -141.06 144.42 34.94 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 54.8 t -130.38 131.79 65.17 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.54 134.3 33.72 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.7 m -131.16 132.21 44.59 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 122.19 0.995 . . . . 0.0 109.099 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -113.97 132.15 56.07 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.8 t -164.17 179.19 7.05 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.91 99.93 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.297 0 CA-C-O 122.628 1.204 . . . . 0.0 109.383 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.8 t -100.59 144.53 28.67 Favored Pre-proline 0 C--N 1.354 0.779 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -49.37 149.71 8.98 Favored 'Trans proline' 0 CA--C 1.501 -1.136 0 C-N-CA 122.526 2.15 . . . . 0.0 116.334 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.0 tp -46.72 -51.06 40.12 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.27 -6.35 17.11 Favored 'Trans proline' 0 C--N 1.353 0.778 0 CA-C-N 121.44 1.55 . . . . 0.0 112.425 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.25 27.23 9.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.898 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -68.54 64.8 0.11 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-O 121.252 0.549 . . . . 0.0 110.582 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.2 mtt -125.02 152.87 43.68 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.784 0.802 . . . . 0.0 108.966 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.7 m -95.92 132.86 40.76 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -109.99 131.91 54.63 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 122.194 2.27 . . . . 0.0 109.824 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.5 t -125.08 137.45 54.2 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -115.18 125.33 53.28 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.3 129.33 47.49 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.09 138.87 39.35 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -86.02 112.3 21.1 Favored 'General case' 0 C--N 1.349 0.575 0 O-C-N 121.266 -0.896 . . . . 0.0 109.205 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.1 t30 63.83 26.69 14.41 Favored 'General case' 0 C--N 1.372 1.569 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.131 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 64.93 24.19 12.66 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 123.529 0.732 . . . . 0.0 110.895 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.63 116.15 28.75 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.59 -25.38 68.05 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -75.79 -14.15 60.3 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 121.195 -0.941 . . . . 0.0 109.613 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.9 mt -116.94 85.6 2.35 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.3 m -120.36 130.19 54.29 Favored 'General case' 0 C--N 1.361 1.106 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -109.17 132.3 54.24 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -118.5 107.88 14.32 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.8 mm -118.87 118.96 59.53 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.191 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.97 141.97 46.36 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -150.08 160.14 34.05 Favored Pre-proline 0 CA--C 1.51 -0.564 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.31 150.38 15.01 Favored 'Trans proline' 0 N--CA 1.485 0.979 0 C-N-CA 122.16 1.907 . . . . 0.0 111.716 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -62.7 -19.18 63.63 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 120.323 -1.486 . . . . 0.0 113.728 -174.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -89.1 -24.58 22.23 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.45 -29.34 16.31 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 123.124 0.57 . . . . 0.0 111.137 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.68 -39.82 94.32 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 122.035 -0.416 . . . . 0.0 111.905 -176.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -63.97 -37.53 87.74 Favored 'General case' 0 C--N 1.359 0.995 0 O-C-N 120.447 -1.408 . . . . 0.0 110.269 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -58.16 -41.36 83.63 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 120.271 1.396 . . . . 0.0 109.593 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -61.19 -48.3 82.18 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 109.952 175.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.92 -41.54 91.97 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.762 -176.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.72 -45.45 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 121.429 -0.794 . . . . 0.0 109.59 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.82 -40.8 98.49 Favored 'General case' 0 C--N 1.36 1.049 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.125 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -62.65 -47.65 82.79 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 122.635 0.374 . . . . 0.0 110.728 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.12 -44.94 82.85 Favored 'General case' 0 C--N 1.36 1.058 0 CA-C-O 121.446 0.641 . . . . 0.0 109.864 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.5 ttt -61.81 -48.73 79.3 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.482 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.14 -46.66 92.75 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 121.282 -0.886 . . . . 0.0 113.617 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -88.15 -39.22 14.71 Favored 'General case' 0 C--N 1.36 1.053 0 CA-C-N 119.328 1.564 . . . . 0.0 113.793 -176.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -83.86 -53.38 5.64 Favored 'General case' 0 C--N 1.354 0.787 0 O-C-N 120.29 -1.507 . . . . 0.0 111.983 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -62.84 -40.78 98.49 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.3 mmt -85.41 -20.69 29.45 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 121.017 -1.052 . . . . 0.0 110.833 -176.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 60.03 53.78 4.46 Favored 'General case' 0 C--N 1.366 1.316 0 CA-C-O 122.387 1.089 . . . . 0.0 111.835 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.73 155.36 38.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.5 m -109.85 55.53 0.64 Allowed 'General case' 0 C--N 1.364 1.237 0 CA-C-O 122.127 0.965 . . . . 0.0 108.677 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -132.49 115.34 15.38 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.449 -1.685 . . . . 0.0 106.449 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -85.4 144.72 40.98 Favored Pre-proline 0 C--N 1.35 0.622 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -63.77 143.79 87.24 Favored 'Trans proline' 0 CA--C 1.518 -0.28 0 C-N-CA 121.48 1.453 . . . . 0.0 112.793 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.89 96.54 Favored Glycine 0 C--N 1.355 1.627 0 O-C-N 121.743 -0.598 . . . . 0.0 112.906 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -73.17 -28.32 62.15 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.903 1.351 . . . . 0.0 109.681 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -73.34 -36.53 66.18 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -70.6 -23.14 62.51 Favored 'General case' 0 C--N 1.365 1.279 0 O-C-N 121.909 -0.494 . . . . 0.0 110.369 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -61.83 -47.0 87.03 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-O 122.189 0.995 . . . . 0.0 109.345 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -66.31 -39.32 89.21 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.649 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.07 -43.4 78.66 Favored 'General case' 0 C--N 1.364 1.203 0 O-C-N 121.826 -0.546 . . . . 0.0 110.332 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.58 -40.87 89.16 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.362 1.976 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -179.998 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.406 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 57.1 ttp180 . . . . . 0 CA--C 1.519 -0.226 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.2 pt -61.73 -20.66 23.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.272 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.406 ' H ' ' HG2' ' A' ' 2' ' ' ARG . 98.4 m-20 -74.08 -9.91 59.09 Favored 'General case' 0 C--N 1.362 1.13 0 O-C-N 121.373 -0.829 . . . . 0.0 110.248 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -90.29 -6.9 54.61 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 80.7 mt -106.84 -108.67 0.31 Allowed 'General case' 0 C--N 1.352 0.701 0 CA-C-O 122.099 0.952 . . . . 0.0 109.253 -178.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.4 p -89.62 152.49 47.13 Favored Pre-proline 0 C--O 1.236 0.389 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -57.68 125.99 20.44 Favored 'Trans proline' 0 C--N 1.348 0.539 0 CA-C-N 119.737 0.942 . . . . 0.0 111.259 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.89 120.09 23.0 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 123.251 1.501 . . . . 0.0 112.761 -175.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -83.49 162.32 53.84 Favored Pre-proline 0 N--CA 1.443 -0.787 0 CA-C-N 113.388 -1.733 . . . . 0.0 106.403 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -55.79 -24.59 47.49 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.488 2.125 . . . . 0.0 113.692 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.6 mtt180 -75.13 -52.25 11.43 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 124.513 1.125 . . . . 0.0 108.289 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.8 77.95 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.23 1.412 . . . . 0.0 110.802 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -60.96 -44.05 97.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.565 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.17 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.3 m -72.69 -37.46 67.84 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.79 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.71 -40.64 76.17 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 121.583 -0.698 . . . . 0.0 110.297 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -71.23 -20.44 62.25 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.1 m -58.95 -54.84 52.47 Favored Pre-proline 0 N--CA 1.486 1.349 0 O-C-N 120.976 -1.078 . . . . 0.0 113.422 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo . . . . . 0 C--N 1.348 0.514 0 CA-C-N 121.323 1.508 . . . . 0.0 113.958 178.367 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 . . . . . 0 CA--C 1.534 0.338 0 CA-C-O 119.822 -0.132 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.439 ' HB3' ' HD3' ' A' ' 31' ' ' PRO . 46.0 tp -64.96 -56.06 23.34 Favored Pre-proline 0 C--N 1.367 1.331 0 O-C-N 121.367 -0.833 . . . . 0.0 112.431 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 30' ' ' LEU . 37.7 Cg_exo -61.52 -23.08 76.05 Favored 'Trans proline' 0 C--N 1.358 1.047 0 CA-C-N 121.185 1.459 . . . . 0.0 115.09 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -68.16 -36.26 79.37 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.96 -19.13 60.24 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 121.955 -0.466 . . . . 0.0 109.952 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.8 mt -70.77 -20.12 62.64 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 121.378 -0.827 . . . . 0.0 109.821 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.6 m -84.68 -18.25 35.92 Favored 'General case' 0 C--N 1.351 0.657 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 70.0 mt -88.38 -43.79 11.24 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -55.61 -25.68 39.95 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 124.466 1.106 . . . . 0.0 113.07 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.21 -10.5 54.9 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 121.444 -0.785 . . . . 0.0 111.892 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.58 5.64 11.03 Favored Glycine 0 C--N 1.375 2.703 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 m -71.17 -43.03 68.29 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 118.259 1.029 . . . . 0.0 109.293 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.6 t 67.33 179.77 0.22 Allowed 'General case' 0 C--N 1.374 1.656 0 CA-C-O 121.592 0.71 . . . . 0.0 110.712 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.0 mp -136.09 125.16 38.63 Favored 'Isoleucine or valine' 0 C--N 1.358 0.972 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -150.98 127.39 10.69 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 103.285 -2.857 . . . . 0.0 103.285 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -179.83 -172.36 43.77 Favored Glycine 0 CA--C 1.493 -1.313 0 N-CA-C 108.539 -1.824 . . . . 0.0 108.539 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 51.1 m -121.09 115.72 23.63 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -95.72 132.47 40.88 Favored 'General case' 0 C--N 1.355 0.812 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.25 22.52 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-O 122.663 1.22 . . . . 0.0 110.146 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 91.6 t -101.21 115.56 43.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 N-CA-C 104.334 -2.469 . . . . 0.0 104.334 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -70.61 136.56 49.26 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.52 -6.1 57.36 Favored Glycine 0 C--N 1.359 1.839 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.1 -103.38 0.4 Allowed Glycine 0 C--N 1.355 1.604 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.12 160.87 24.46 Favored Pre-proline 0 N--CA 1.448 -0.563 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -177.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.9 126.17 10.46 Favored 'Trans proline' 0 CA--C 1.513 -0.528 0 C-N-CA 121.353 1.369 . . . . 0.0 113.403 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 2.7 pt -109.47 137.42 41.69 Favored 'Isoleucine or valine' 0 C--N 1.357 0.913 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.7 m -65.84 143.93 57.16 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-O 122.078 0.942 . . . . 0.0 111.466 178.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -140.92 144.42 35.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.9 t -129.2 131.96 67.32 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 N-CA-C 106.486 -1.672 . . . . 0.0 106.486 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.64 130.15 29.63 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.5 m -128.12 131.09 49.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.505 1.145 . . . . 0.0 109.554 -177.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -110.95 124.36 51.98 Favored 'General case' 0 C--N 1.354 0.791 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.5 m -152.01 147.56 26.66 Favored 'General case' 0 CA--C 1.488 -1.413 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -71.19 100.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-O 122.694 1.235 . . . . 0.0 110.765 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.7 p -99.87 161.86 22.97 Favored Pre-proline 0 C--N 1.354 0.767 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 178.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -51.29 153.78 9.22 Favored 'Trans proline' 0 C--O 1.206 -1.122 0 C-N-CA 122.151 1.9 . . . . 0.0 115.721 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.6 tp -46.45 -54.31 19.2 Favored Pre-proline 0 CA--C 1.549 0.918 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -74.1 -6.9 19.18 Favored 'Trans proline' 0 C--N 1.353 0.77 0 CA-C-N 121.321 1.507 . . . . 0.0 112.946 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.35 24.97 10.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.333 -0.849 . . . . 0.0 108.962 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -73.63 68.91 1.24 Allowed 'General case' 0 C--N 1.379 1.877 0 CA-C-O 121.927 0.87 . . . . 0.0 109.471 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.7 mtt -120.5 154.11 35.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.916 0.865 . . . . 0.0 109.896 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 79.3 m -96.33 137.03 36.0 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 -112.69 130.16 56.15 Favored 'General case' 0 C--N 1.36 1.057 0 CA-C-N 122.261 2.301 . . . . 0.0 109.385 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.5 t -123.36 138.77 54.53 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -120.07 125.25 47.84 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.6 mt -128.43 140.24 51.94 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.5 pm0 -127.97 142.9 51.11 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 178.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -91.1 124.2 35.14 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.534 -0.729 . . . . 0.0 110.793 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 60.87 24.15 14.15 Favored 'General case' 0 C--N 1.374 1.649 0 C-N-CA 124.176 0.99 . . . . 0.0 110.995 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 63.38 26.89 15.15 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 123.344 0.658 . . . . 0.0 110.534 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -93.11 122.36 35.4 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.76 -16.16 63.72 Favored 'General case' 0 C--N 1.352 0.698 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -88.0 -2.88 58.88 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 120.863 -1.148 . . . . 0.0 109.466 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.2 mt -124.05 94.87 4.35 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 -178.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 74.2 p -128.67 151.05 49.96 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-O 121.755 0.788 . . . . 0.0 109.174 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -137.4 132.52 33.6 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.83 111.62 18.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 103.489 -2.782 . . . . 0.0 103.489 177.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.8 mm -119.3 117.82 55.38 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.985 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.2 139.63 44.67 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -152.92 162.64 25.87 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -52.55 149.27 24.56 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 C-N-CA 122.389 2.059 . . . . 0.0 112.298 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -59.52 -19.82 50.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.964 -1.085 . . . . 0.0 113.814 -174.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -88.77 -45.58 9.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -71.53 -35.45 70.69 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.197 0.599 . . . . 0.0 111.068 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -62.72 -38.99 92.67 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 123.033 0.533 . . . . 0.0 111.673 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.03 -26.38 67.49 Favored 'General case' 0 C--O 1.207 -1.18 0 O-C-N 120.286 -1.509 . . . . 0.0 110.619 -177.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.99 -40.77 97.14 Favored 'General case' 0 C--N 1.374 1.647 0 CA-C-N 119.993 1.27 . . . . 0.0 108.585 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -61.99 -47.11 86.29 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 123.935 0.894 . . . . 0.0 109.507 175.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.1 tp -60.89 -42.69 98.48 Favored 'General case' 0 C--N 1.357 0.929 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.739 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -45.95 97.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.416 -0.803 . . . . 0.0 109.653 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.71 -41.25 99.05 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.481 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 66.4 ttp -63.07 -48.7 77.5 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 122.686 0.394 . . . . 0.0 111.092 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -66.35 -45.95 78.44 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-O 121.604 0.716 . . . . 0.0 109.9 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.85 -50.33 71.35 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.157 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.12 -45.1 97.23 Favored Glycine 0 C--N 1.359 1.83 0 CA-C-O 119.123 -0.821 . . . . 0.0 115.112 -174.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -84.57 -33.59 23.38 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-N 119.827 1.813 . . . . 0.0 111.867 -176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -82.13 -49.52 10.07 Favored 'General case' 0 C--N 1.349 0.574 0 O-C-N 120.851 -1.156 . . . . 0.0 111.672 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -64.54 -43.82 92.75 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -85.22 -22.08 28.83 Favored 'General case' 0 C--N 1.367 1.33 0 O-C-N 120.684 -1.26 . . . . 0.0 110.704 -176.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 61.46 40.84 13.41 Favored 'General case' 0 C--N 1.367 1.364 0 CA-C-O 122.434 1.112 . . . . 0.0 110.461 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -125.46 147.57 49.16 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.386 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.4 p -91.06 -10.86 40.58 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -81.99 118.75 23.23 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -85.48 151.39 55.98 Favored Pre-proline 0 C--N 1.347 0.491 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -62.53 141.12 85.2 Favored 'Trans proline' 0 N--CA 1.473 0.322 0 C-N-CA 121.508 1.472 . . . . 0.0 113.078 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.6 -38.94 96.68 Favored Glycine 0 C--N 1.356 1.667 0 O-C-N 121.934 -0.478 . . . . 0.0 112.827 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.24 -29.45 63.95 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 118.811 1.305 . . . . 0.0 109.654 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.93 -35.32 67.0 Favored 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -70.75 -22.46 62.4 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 121.795 -0.566 . . . . 0.0 110.177 -178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -62.74 -45.77 91.16 Favored 'General case' 0 C--N 1.364 1.223 0 CA-C-O 122.136 0.969 . . . . 0.0 108.964 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.89 -40.21 96.85 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.809 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.62 -43.45 69.24 Favored 'General case' 0 C--N 1.358 0.978 0 O-C-N 122.065 -0.397 . . . . 0.0 110.385 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 55.6 tp -66.93 -40.67 87.66 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.834 0.454 . . . . 0.0 110.272 -179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.364 2.121 0 N-CA-C 110.039 -1.224 . . . . 0.0 110.039 179.304 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.7 ptt-85 . . . . . 0 C--O 1.236 0.356 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.9 pt -63.49 -21.59 28.83 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -79.44 -8.92 59.46 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 121.083 -1.011 . . . . 0.0 111.041 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -101.79 -1.62 31.93 Favored 'General case' 0 C--N 1.36 1.029 0 O-C-N 121.599 -0.688 . . . . 0.0 109.499 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.9 mt -102.77 -120.45 0.19 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-O 121.966 0.888 . . . . 0.0 108.785 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -89.23 158.43 46.49 Favored Pre-proline 0 C--N 1.347 0.459 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -53.99 126.59 22.52 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 120.821 1.014 . . . . 0.0 112.617 177.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.07 118.8 18.42 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 123.2 1.476 . . . . 0.0 112.067 -176.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -84.24 160.74 56.59 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-N 113.372 -1.74 . . . . 0.0 106.909 176.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.08 -19.03 61.46 Favored 'Trans proline' 0 N--CA 1.486 1.072 0 C-N-CA 122.039 1.826 . . . . 0.0 113.416 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -76.5 -53.07 8.6 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.19 -46.59 79.33 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 125.436 1.495 . . . . 0.0 110.823 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -60.96 -42.67 93.77 Favored 'Isoleucine or valine' 0 C--N 1.349 0.576 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.9 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.3 m -71.52 -36.56 71.07 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.385 -176.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.2 mt -70.51 -40.67 73.37 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 121.656 -0.652 . . . . 0.0 110.323 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -72.42 -22.14 61.15 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -59.34 -54.58 54.78 Favored Pre-proline 0 N--CA 1.485 1.325 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo . . . . . 0 C--N 1.349 0.56 0 CA-C-N 121.308 1.503 . . . . 0.0 114.266 179.331 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 CA--C 1.532 0.277 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.0 tp -67.14 -56.02 14.33 Favored Pre-proline 0 C--N 1.365 1.245 0 O-C-N 121.238 -0.914 . . . . 0.0 112.9 -177.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.99 -18.31 31.33 Favored 'Trans proline' 0 C--N 1.356 0.974 0 CA-C-N 121.112 1.433 . . . . 0.0 114.046 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -69.41 -36.1 76.41 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.56 -18.48 59.74 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.932 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.91 -36.18 82.67 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 121.412 -0.805 . . . . 0.0 108.905 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -64.27 -38.25 90.36 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.001 -0.437 . . . . 0.0 110.044 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mp -68.31 -43.98 76.42 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -55.01 -28.42 51.93 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 124.763 1.225 . . . . 0.0 112.602 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -65.09 -19.94 66.23 Favored 'General case' 0 C--N 1.361 1.099 0 O-C-N 121.257 -0.902 . . . . 0.0 111.064 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.23 11.21 7.58 Favored Glycine 0 C--N 1.36 1.915 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.3 m -65.73 -43.84 87.81 Favored 'General case' 0 C--N 1.361 1.088 0 CA-C-N 117.552 0.676 . . . . 0.0 109.437 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.9 m 65.28 173.94 0.21 Allowed 'General case' 0 C--N 1.375 1.675 0 CA-C-O 121.969 0.89 . . . . 0.0 111.356 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.7 mp -136.24 127.06 42.37 Favored 'Isoleucine or valine' 0 C--N 1.36 1.024 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -151.47 126.03 9.52 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 103.187 -2.894 . . . . 0.0 103.187 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.75 -169.19 41.08 Favored Glycine 0 CA--C 1.492 -1.367 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 p -121.54 115.9 23.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -92.56 130.45 38.2 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.85 118.49 22.41 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 122.874 1.321 . . . . 0.0 110.746 -176.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.4 t -99.01 109.55 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 176.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -70.31 132.5 45.78 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.59 -8.69 58.48 Favored Glycine 0 C--N 1.358 1.787 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.14 -107.12 0.9 Allowed Glycine 0 C--N 1.355 1.628 0 N-CA-C 108.668 -1.773 . . . . 0.0 108.668 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.5 157.98 24.69 Favored Pre-proline 0 N--CA 1.445 -0.697 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.78 124.95 9.12 Favored 'Trans proline' 0 CA--C 1.514 -0.508 0 C-N-CA 121.156 1.237 . . . . 0.0 112.891 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 pt -109.34 136.8 44.13 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 CA-C-O 122.055 0.931 . . . . 0.0 108.866 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.8 m -65.62 141.34 58.44 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-O 122.127 0.965 . . . . 0.0 111.918 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -140.74 144.09 35.33 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -130.49 131.89 64.9 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.35 131.96 30.8 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 66.8 p -129.56 157.88 40.84 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.31 1.053 . . . . 0.0 109.431 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -121.74 133.79 54.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 95.6 m -155.89 140.75 17.17 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.68 100.86 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-O 122.503 1.145 . . . . 0.0 109.924 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -99.54 164.44 16.61 Favored Pre-proline 0 C--N 1.354 0.786 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -52.41 155.76 9.27 Favored 'Trans proline' 0 C--O 1.206 -1.123 0 C-N-CA 122.249 1.966 . . . . 0.0 115.649 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.26 -53.66 37.25 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.04 -6.64 18.83 Favored 'Trans proline' 0 C--N 1.351 0.707 0 CA-C-N 121.247 1.481 . . . . 0.0 112.704 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.18 24.54 11.09 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.845 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.92 71.0 2.71 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -120.74 153.27 37.22 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.965 0.888 . . . . 0.0 109.976 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -95.38 135.17 37.33 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 178.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -111.11 131.32 55.18 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 121.94 2.154 . . . . 0.0 109.536 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.4 t -125.2 136.94 54.07 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.28 125.24 53.05 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.2 mt -126.55 129.18 48.09 Favored 'General case' 0 C--N 1.353 0.758 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.04 137.86 40.67 Favored 'General case' 0 C--N 1.356 0.874 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -85.79 110.04 19.08 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 121.369 -0.832 . . . . 0.0 109.667 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.0 t30 65.55 26.61 11.67 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 123.707 0.803 . . . . 0.0 109.948 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 65.08 24.1 12.48 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 123.519 0.728 . . . . 0.0 110.873 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.28 115.84 28.43 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.36 -26.08 68.25 Favored 'General case' 0 C--N 1.356 0.88 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -75.34 -14.62 60.49 Favored 'General case' 0 C--N 1.362 1.135 0 O-C-N 121.307 -0.871 . . . . 0.0 109.713 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.8 mt -116.53 84.26 2.1 Favored 'General case' 0 C--N 1.351 0.637 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.6 m -119.63 129.68 54.71 Favored 'General case' 0 C--N 1.361 1.081 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -109.39 133.17 53.4 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.58 109.29 15.99 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 103.467 -2.79 . . . . 0.0 103.467 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -119.02 117.7 55.15 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -176.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.34 140.63 45.22 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.3 mp -154.2 161.57 28.97 Favored Pre-proline 0 C--O 1.242 0.666 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 -179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -53.27 145.91 42.37 Favored 'Trans proline' 0 CA--C 1.508 -0.813 0 C-N-CA 122.059 1.839 . . . . 0.0 111.788 176.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -60.51 -20.21 59.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.084 -1.01 . . . . 0.0 113.51 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -87.95 -22.82 24.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.682 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -95.69 -33.71 12.22 Favored 'General case' 0 C--N 1.361 1.084 0 O-C-N 121.821 -0.549 . . . . 0.0 111.069 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.85 -41.22 97.57 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -175.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.7 -32.7 73.83 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 120.678 -1.264 . . . . 0.0 111.228 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.36 -41.16 79.58 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.688 1.131 . . . . 0.0 109.753 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -66.87 -41.35 87.44 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 121.698 -0.626 . . . . 0.0 109.951 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -43.05 98.97 Favored 'General case' 0 C--N 1.357 0.921 0 CA-C-O 120.525 0.202 . . . . 0.0 111.018 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -43.84 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.642 -0.661 . . . . 0.0 109.378 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.99 -40.65 96.36 Favored 'General case' 0 C--N 1.363 1.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.056 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.9 ttp -62.66 -47.92 81.57 Favored 'General case' 0 C--N 1.356 0.855 0 CA-C-O 120.995 0.426 . . . . 0.0 110.794 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.87 -44.73 80.18 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 121.516 0.674 . . . . 0.0 109.709 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -62.17 -48.64 79.16 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.293 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.73 -46.6 93.34 Favored Glycine 0 C--N 1.354 1.562 0 O-C-N 121.243 -0.911 . . . . 0.0 113.753 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -87.46 -39.28 15.35 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 119.54 1.67 . . . . 0.0 113.436 -176.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -82.51 -52.17 7.11 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.249 -1.532 . . . . 0.0 112.036 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -63.68 -41.75 98.13 Favored 'General case' 0 C--N 1.357 0.927 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 22.4 mmt -87.53 -22.72 24.69 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 121.017 -1.052 . . . . 0.0 110.714 -176.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 61.12 36.63 18.14 Favored 'General case' 0 C--N 1.366 1.31 0 CA-C-O 122.327 1.061 . . . . 0.0 110.854 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -116.16 140.37 49.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.327 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 t -89.19 -7.42 55.65 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -86.34 108.86 18.63 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -78.86 151.96 76.94 Favored Pre-proline 0 C--N 1.351 0.661 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.66 139.58 76.15 Favored 'Trans proline' 0 CA--C 1.517 -0.337 0 C-N-CA 121.668 1.579 . . . . 0.0 113.434 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.42 96.05 Favored Glycine 0 C--N 1.357 1.727 0 O-C-N 121.903 -0.498 . . . . 0.0 112.388 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.4 -34.07 75.38 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.612 1.206 . . . . 0.0 109.943 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -70.14 -40.03 75.05 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -71.21 -30.41 66.35 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 121.946 -0.471 . . . . 0.0 110.332 -178.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -60.72 -49.73 76.33 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.756 0.788 . . . . 0.0 110.05 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -67.16 -41.47 85.94 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.347 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.14 -41.27 74.1 Favored 'General case' 0 C--N 1.357 0.921 0 O-C-N 121.889 -0.507 . . . . 0.0 111.108 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.0 tp -69.71 -40.22 76.39 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 121.713 -0.617 . . . . 0.0 109.91 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.223 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.796 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 . . . . . 0 CA--C 1.518 -0.255 0 CA-C-O 121.736 0.779 . . . . 0.0 109.138 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.8 mm -61.47 -36.7 74.86 Favored 'Isoleucine or valine' 0 C--N 1.364 1.204 0 C-N-CA 124.088 0.955 . . . . 0.0 110.705 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -63.52 -15.06 56.87 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -176.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -91.69 -4.43 55.15 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 121.44 -0.787 . . . . 0.0 109.323 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.3 mt -106.37 -107.44 0.31 Allowed 'General case' 0 C--N 1.35 0.59 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -90.69 158.01 43.14 Favored Pre-proline 0 C--N 1.345 0.401 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -56.5 128.11 28.7 Favored 'Trans proline' 0 N--CA 1.477 0.537 0 CA-C-N 119.703 0.93 . . . . 0.0 112.416 176.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.14 119.82 24.07 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 123.138 1.447 . . . . 0.0 111.905 -176.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -83.5 162.72 52.54 Favored Pre-proline 0 N--CA 1.443 -0.805 0 CA-C-N 113.484 -1.689 . . . . 0.0 106.716 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -55.86 -26.52 58.07 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 122.361 2.04 . . . . 0.0 113.401 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -72.54 -50.52 25.1 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 108.578 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -46.01 85.37 Favored 'General case' 0 C--N 1.363 1.169 0 C-N-CA 125.612 1.565 . . . . 0.0 110.935 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -61.04 -43.24 95.76 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.685 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.9 m -71.91 -36.86 70.11 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.187 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.22 -39.1 82.45 Favored 'General case' 0 C--N 1.37 1.461 0 O-C-N 121.325 -0.859 . . . . 0.0 110.199 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -74.24 -16.27 60.96 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.817 -0.552 . . . . 0.0 112.184 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.7 m -61.8 -52.03 71.59 Favored Pre-proline 0 N--CA 1.486 1.372 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo . . . . . 0 N--CA 1.487 1.113 0 CA-C-N 121.553 1.59 . . . . 0.0 115.439 179.832 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 . . . . . 0 N--CA 1.466 0.337 0 N-CA-C 111.584 0.216 . . . . 0.0 111.584 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.9 tp -64.1 -57.06 19.7 Favored Pre-proline 0 C--N 1.365 1.24 0 O-C-N 121.463 -0.773 . . . . 0.0 112.399 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.92 -17.26 32.45 Favored 'Trans proline' 0 C--N 1.355 0.921 0 CA-C-N 120.638 1.263 . . . . 0.0 114.957 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -68.32 -37.19 80.33 Favored 'General case' 0 C--N 1.359 1.007 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.44 -18.5 60.63 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 121.957 -0.465 . . . . 0.0 110.039 -177.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.5 mt -72.38 -22.32 61.15 Favored 'General case' 0 C--N 1.36 1.051 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 66.0 m -84.77 -25.39 28.25 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.4 mp -74.92 -41.34 59.88 Favored 'General case' 0 C--N 1.358 0.958 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.97 -29.14 59.78 Favored 'General case' 0 C--N 1.358 0.94 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.638 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -64.01 -13.32 45.83 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 121.285 -0.884 . . . . 0.0 112.79 -177.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.64 2.36 14.82 Favored Glycine 0 C--N 1.376 2.777 0 CA-C-N 119.953 1.251 . . . . 0.0 110.854 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.6 m -70.4 -42.17 72.04 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-N 118.531 1.165 . . . . 0.0 109.975 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 t 64.83 -175.9 0.17 Allowed 'General case' 0 C--N 1.372 1.572 0 CA-C-O 121.477 0.656 . . . . 0.0 110.943 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.8 mp -138.27 125.97 29.03 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -152.35 126.91 9.41 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.451 -2.796 . . . . 0.0 103.451 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.83 -169.02 40.8 Favored Glycine 0 CA--C 1.494 -1.245 0 N-CA-C 108.667 -1.773 . . . . 0.0 108.667 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.8 m -122.1 117.17 25.65 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -95.04 130.78 41.58 Favored 'General case' 0 C--N 1.355 0.807 0 N-CA-C 107.424 -1.325 . . . . 0.0 107.424 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.93 118.71 23.17 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-O 122.725 1.25 . . . . 0.0 109.8 -177.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 81.4 t -101.86 115.33 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.236 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -71.13 138.46 49.67 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.628 0.728 . . . . 0.0 109.479 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.21 -8.55 62.8 Favored Glycine 0 C--N 1.36 1.874 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.97 -103.53 0.55 Allowed Glycine 0 C--N 1.356 1.642 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.83 159.48 22.32 Favored Pre-proline 0 N--CA 1.447 -0.58 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.18 123.72 7.99 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.382 1.388 . . . . 0.0 112.84 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.4 pt -109.1 137.1 42.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.841 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 77.3 p -67.78 148.02 51.8 Favored 'General case' 0 C--N 1.364 1.206 0 CA-C-O 122.695 1.236 . . . . 0.0 112.188 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -145.8 146.52 31.21 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -129.86 130.76 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.75 135.79 35.06 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -134.99 154.1 51.85 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.406 1.098 . . . . 0.0 109.781 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.26 124.94 35.72 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.8 m -152.63 151.48 30.66 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 103.311 -2.848 . . . . 0.0 103.311 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.57 101.31 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 122.525 1.155 . . . . 0.0 111.177 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.1 p -99.25 157.34 34.21 Favored Pre-proline 0 C--N 1.352 0.717 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 176.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -50.46 151.05 10.58 Favored 'Trans proline' 0 CA--C 1.498 -1.293 0 C-N-CA 122.092 1.862 . . . . 0.0 115.586 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 tp -45.74 -52.97 22.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.01 -6.66 18.87 Favored 'Trans proline' 0 C--N 1.352 0.746 0 CA-C-N 121.582 1.601 . . . . 0.0 113.127 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.6 25.91 10.08 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 43.8 p-10 -72.67 63.41 0.6 Allowed 'General case' 0 C--N 1.374 1.635 0 CA-C-O 121.822 0.82 . . . . 0.0 111.328 -177.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -116.39 153.39 32.13 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 122.107 0.956 . . . . 0.0 110.244 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.8 m -96.72 135.8 38.14 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 104.829 -2.286 . . . . 0.0 104.829 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -113.32 132.51 55.54 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.285 2.311 . . . . 0.0 109.914 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 12.3 t -125.73 138.3 53.86 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -115.88 125.05 52.11 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 177.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.5 mt -127.07 128.15 45.82 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -104.84 135.78 45.57 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -85.99 114.3 22.77 Favored 'General case' 0 C--N 1.345 0.409 0 O-C-N 121.398 -0.814 . . . . 0.0 109.622 -177.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 63.58 25.52 14.39 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 123.825 0.85 . . . . 0.0 110.552 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 63.71 27.82 14.82 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 123.452 0.701 . . . . 0.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -96.36 114.29 25.95 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.03 -25.52 67.71 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -74.0 -16.71 61.05 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.265 -0.897 . . . . 0.0 109.416 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.7 mt -114.55 80.84 1.46 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 106.851 -1.536 . . . . 0.0 106.851 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.7 m -118.87 128.56 54.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -177.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -110.0 133.43 53.2 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -117.45 109.66 17.03 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 103.224 -2.88 . . . . 0.0 103.224 178.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.0 mm -118.82 118.74 58.79 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.165 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.14 141.57 45.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mp -150.67 160.32 32.77 Favored Pre-proline 0 CA--C 1.51 -0.562 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 -178.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -52.78 149.73 24.57 Favored 'Trans proline' 0 N--CA 1.482 0.848 0 C-N-CA 122.116 1.877 . . . . 0.0 111.273 176.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -62.35 -18.49 61.62 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.701 -1.25 . . . . 0.0 113.778 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -88.94 -22.94 22.82 Favored 'General case' 0 C--N 1.35 0.619 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -95.31 -30.13 14.11 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 122.002 -0.436 . . . . 0.0 110.772 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -64.66 -40.17 94.96 Favored 'General case' 0 C--N 1.364 1.196 0 O-C-N 121.919 -0.488 . . . . 0.0 111.62 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.28 -37.81 88.83 Favored 'General case' 0 C--N 1.36 1.041 0 O-C-N 120.355 -1.466 . . . . 0.0 109.814 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -58.98 -41.18 86.95 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 120.051 1.296 . . . . 0.0 109.487 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -61.03 -48.98 79.25 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 123.828 0.851 . . . . 0.0 109.939 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -40.94 88.16 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.021 0.528 . . . . 0.0 112.133 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.8 -46.91 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.57 -0.706 . . . . 0.0 109.851 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.77 -42.55 99.74 Favored 'General case' 0 C--N 1.359 0.994 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.395 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 64.2 ttp -63.52 -48.32 78.02 Favored 'General case' 0 C--N 1.356 0.873 0 CA-C-O 121.006 0.431 . . . . 0.0 110.859 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.6 tp -64.75 -49.16 71.88 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.367 0.603 . . . . 0.0 110.532 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.3 ttp -61.78 -50.28 72.97 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 122.834 0.453 . . . . 0.0 112.035 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.36 -44.69 97.72 Favored Glycine 0 C--N 1.359 1.812 0 CA-C-O 119.048 -0.862 . . . . 0.0 114.748 -174.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -84.6 -32.3 23.82 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.707 1.753 . . . . 0.0 112.085 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -83.47 -50.63 8.1 Favored 'General case' 0 C--N 1.35 0.592 0 O-C-N 120.79 -1.194 . . . . 0.0 111.5 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.8 ttt180 -63.37 -42.49 98.87 Favored 'General case' 0 C--N 1.358 0.97 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 38.7 mmt -82.33 -21.33 36.08 Favored 'General case' 0 C--N 1.368 1.407 0 O-C-N 120.757 -1.215 . . . . 0.0 110.395 -177.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 60.93 39.06 17.15 Favored 'General case' 0 C--N 1.369 1.427 0 CA-C-O 122.472 1.13 . . . . 0.0 110.494 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -137.32 145.69 43.72 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.033 -1.44 . . . . 0.0 107.239 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.3 m -95.83 56.34 1.72 Allowed 'General case' 0 C--N 1.358 0.939 0 CA-C-O 122.308 1.051 . . . . 0.0 108.252 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -127.09 132.95 50.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -105.55 148.15 35.87 Favored Pre-proline 0 C--N 1.349 0.582 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -65.06 141.56 70.61 Favored 'Trans proline' 0 CA--C 1.518 -0.287 0 C-N-CA 121.255 1.303 . . . . 0.0 112.191 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -39.56 97.42 Favored Glycine 0 C--N 1.357 1.731 0 O-C-N 121.818 -0.551 . . . . 0.0 112.769 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.33 -31.59 68.95 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 118.637 1.218 . . . . 0.0 109.926 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -71.16 -33.26 69.86 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -73.53 -17.46 61.2 Favored 'General case' 0 C--N 1.363 1.19 0 O-C-N 121.596 -0.69 . . . . 0.0 111.005 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -65.96 -43.01 89.18 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -64.76 -39.07 93.01 Favored 'General case' 0 C--N 1.353 0.725 0 CA-C-N 113.168 -1.833 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.12 -43.84 66.82 Favored 'General case' 0 C--N 1.359 0.983 0 O-C-N 121.839 -0.538 . . . . 0.0 110.202 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.5 tp -68.25 -40.62 81.88 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.696 0.398 . . . . 0.0 110.551 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.898 0 N-CA-C 107.918 -2.073 . . . . 0.0 107.918 -178.886 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 . . . . . 0 CA--C 1.514 -0.422 0 CA-C-O 122.068 0.937 . . . . 0.0 109.609 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.0 pt -70.5 -14.15 17.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.478 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.49 -10.47 59.82 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 121.082 -1.011 . . . . 0.0 110.168 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -91.03 -4.66 56.19 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.8 mt -107.16 -114.25 0.27 Allowed 'General case' 0 C--N 1.354 0.783 0 CA-C-O 121.851 0.834 . . . . 0.0 108.773 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -89.98 157.94 45.15 Favored Pre-proline 0 C--N 1.346 0.445 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -56.04 128.8 31.74 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 120.845 1.03 . . . . 0.0 112.283 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.86 118.5 20.95 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-O 123.309 1.528 . . . . 0.0 112.552 -175.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -84.78 161.56 52.91 Favored Pre-proline 0 N--CA 1.443 -0.81 0 CA-C-N 113.252 -1.795 . . . . 0.0 106.328 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.41 -18.18 51.86 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 122.036 1.824 . . . . 0.0 113.568 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -79.07 -52.86 7.63 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.04 1.336 . . . . 0.0 107.624 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.9 -45.93 74.76 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 125.564 1.546 . . . . 0.0 110.987 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.6 t -60.45 -41.17 86.56 Favored 'Isoleucine or valine' 0 C--N 1.351 0.66 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.242 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 60.6 m -78.85 -19.26 52.45 Favored 'General case' 0 C--N 1.365 1.252 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.794 -175.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.2 mt -83.92 -43.38 15.32 Favored 'General case' 0 C--N 1.368 1.371 0 CA-C-N 119.283 0.947 . . . . 0.0 108.615 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -65.32 -42.25 93.18 Favored 'General case' 0 C--N 1.352 0.687 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 56.5 m -53.26 -53.15 59.22 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo . . . . . 0 C--O 1.233 0.252 0 CA-C-N 121.551 1.59 . . . . 0.0 113.859 179.301 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.4 tp -62.39 -51.61 72.11 Favored Pre-proline 0 C--N 1.358 0.936 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.7 -23.01 63.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-N 121.048 1.41 . . . . 0.0 115.633 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -76.69 -28.7 55.99 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 121.359 -0.838 . . . . 0.0 108.838 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.78 -18.65 50.5 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.43 -16.95 61.3 Favored 'General case' 0 C--N 1.359 0.999 0 O-C-N 121.001 -1.062 . . . . 0.0 108.658 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.9 m -85.09 -17.19 38.12 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.7 mp -86.13 -47.67 9.3 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -67.3 -11.53 57.81 Favored 'General case' 0 C--N 1.363 1.17 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.051 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -73.11 -12.26 60.84 Favored 'General case' 0 C--N 1.362 1.109 0 O-C-N 120.749 -1.219 . . . . 0.0 109.034 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.6 10.23 9.54 Favored Glycine 0 C--N 1.377 2.85 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -71.24 -45.54 63.02 Favored 'General case' 0 C--N 1.355 0.848 0 CA-C-N 118.718 1.259 . . . . 0.0 110.935 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.5 t 66.56 177.17 0.23 Allowed 'General case' 0 C--N 1.374 1.636 0 CA-C-O 121.19 0.519 . . . . 0.0 109.795 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.53 129.03 25.04 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 O-C-N 120.642 -1.287 . . . . 0.0 108.931 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -154.65 125.76 7.24 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.3 -168.74 40.65 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 108.545 -1.822 . . . . 0.0 108.545 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 p -121.15 114.92 22.13 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -93.95 131.2 39.64 Favored 'General case' 0 C--N 1.355 0.83 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.95 126.37 31.86 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.762 1.268 . . . . 0.0 109.522 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.4 t -110.46 116.85 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.0 mp0 -73.31 135.54 44.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 94.83 9.42 58.54 Favored Glycine 0 C--N 1.359 1.837 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.96 -107.89 0.26 Allowed Glycine 0 CA--C 1.492 -1.386 0 N-CA-C 109.045 -1.622 . . . . 0.0 109.045 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.4 159.19 20.59 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.93 122.55 7.31 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.32 1.347 . . . . 0.0 112.622 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.0 pt -109.97 137.27 42.99 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 CA-C-O 122.152 0.977 . . . . 0.0 108.776 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.9 m -65.19 140.76 58.79 Favored 'General case' 0 C--N 1.365 1.271 0 CA-C-O 122.143 0.973 . . . . 0.0 111.541 178.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.05 143.5 36.4 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.6 t -129.34 132.6 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -136.32 128.65 30.11 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 177.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 p -127.97 164.58 22.01 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.874 0.845 . . . . 0.0 108.779 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 65.1 p-90 -137.22 153.94 50.28 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 15.3 t -164.41 148.04 9.32 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 176.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -76.62 99.5 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 122.593 1.187 . . . . 0.0 108.994 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.1 p -99.84 160.49 27.15 Favored Pre-proline 0 C--N 1.356 0.853 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 178.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -51.79 153.46 11.41 Favored 'Trans proline' 0 CA--C 1.501 -1.128 0 C-N-CA 122.175 1.917 . . . . 0.0 115.401 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.0 tp -41.09 -54.78 5.43 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.45 -8.48 22.69 Favored 'Trans proline' 0 C--N 1.353 0.789 0 CA-C-N 121.494 1.569 . . . . 0.0 113.303 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.41 24.0 11.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.03 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.76 73.85 3.41 Favored 'General case' 0 C--N 1.375 1.704 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -123.98 153.86 40.65 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.043 0.925 . . . . 0.0 110.886 -176.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.7 m -92.84 137.84 32.01 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -115.13 129.68 56.73 Favored 'General case' 0 C--N 1.364 1.21 0 CA-C-N 122.006 2.184 . . . . 0.0 109.456 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 8.9 t -125.33 140.62 52.66 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-O 122.048 0.928 . . . . 0.0 108.714 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -118.85 124.24 46.67 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 mt -126.45 127.43 45.39 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -100.77 138.91 37.19 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 179.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -85.93 112.14 20.9 Favored 'General case' 0 C--N 1.347 0.47 0 O-C-N 121.395 -0.815 . . . . 0.0 109.113 -177.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.9 25.85 15.27 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 123.755 0.822 . . . . 0.0 110.58 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 66.44 22.48 10.71 Favored 'General case' 0 C--N 1.371 1.533 0 C-N-CA 123.555 0.742 . . . . 0.0 110.864 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -91.87 115.6 28.2 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.43 -24.98 67.72 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -75.55 -14.34 60.4 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 121.331 -0.856 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.0 mt -117.08 87.06 2.62 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -122.07 131.67 54.1 Favored 'General case' 0 C--N 1.359 1.022 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -108.54 130.56 55.28 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -118.54 107.88 14.3 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 103.082 -2.932 . . . . 0.0 103.082 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 51.3 mm -122.91 120.18 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.0 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 -175.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.81 140.12 45.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.4 mp -152.33 161.08 30.31 Favored Pre-proline 0 C--O 1.238 0.486 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -52.82 147.87 30.72 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.2 1.933 . . . . 0.0 112.571 177.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -19.27 58.11 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.926 -1.109 . . . . 0.0 112.893 -175.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.7 p-80 -89.43 -24.54 21.86 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 121.573 -0.704 . . . . 0.0 109.587 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.19 -34.42 12.92 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 121.14 0.495 . . . . 0.0 111.021 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.16 -39.32 92.26 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 123.254 0.622 . . . . 0.0 112.542 -176.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.36 -31.96 73.37 Favored 'General case' 0 C--O 1.203 -1.366 0 O-C-N 120.509 -1.37 . . . . 0.0 110.333 -177.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.34 -42.01 85.9 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 119.862 1.21 . . . . 0.0 109.425 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -61.96 -47.7 83.69 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 123.093 0.557 . . . . 0.0 109.543 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -43.55 98.38 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.712 -176.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -46.03 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 121.431 -0.793 . . . . 0.0 109.485 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.75 -42.64 97.79 Favored 'General case' 0 C--N 1.361 1.097 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.02 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.2 ttp -62.32 -50.14 72.83 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 123.166 0.586 . . . . 0.0 111.27 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -65.67 -48.02 73.5 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-O 121.397 0.618 . . . . 0.0 111.006 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mmt -63.79 -51.87 62.84 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.69 -44.87 95.75 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 -174.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -75.78 -36.84 59.67 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 119.37 1.585 . . . . 0.0 110.738 -176.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -73.78 -45.15 53.45 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 121.793 -0.567 . . . . 0.0 110.845 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -65.35 -46.28 80.82 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.8 mtm -85.4 -22.34 28.42 Favored 'General case' 0 C--N 1.367 1.347 0 O-C-N 120.811 -1.181 . . . . 0.0 111.194 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 60.11 38.64 20.31 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-O 122.338 1.066 . . . . 0.0 110.752 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -137.18 139.52 41.17 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.2 m -94.45 56.31 2.1 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -137.41 108.36 6.71 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.65 154.8 39.81 Favored Pre-proline 0 C--N 1.354 0.764 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -59.96 146.61 95.5 Favored 'Trans proline' 0 N--CA 1.475 0.413 0 C-N-CA 122.027 1.818 . . . . 0.0 113.696 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -66.33 -16.6 65.13 Favored Glycine 0 C--N 1.361 1.966 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.949 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.2 -33.45 73.35 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-N 119.125 1.463 . . . . 0.0 109.3 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -72.6 -34.75 67.61 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -72.26 -23.72 61.25 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.947 -0.47 . . . . 0.0 110.306 -178.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -63.78 -50.45 68.97 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-O 122.122 0.963 . . . . 0.0 109.322 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -67.58 -40.31 84.83 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.193 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -40.15 82.29 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 122.473 0.309 . . . . 0.0 110.863 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 58.4 tp -68.86 -40.93 79.05 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 121.608 -0.683 . . . . 0.0 109.755 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.204 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 179.402 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 . . . . . 0 CA--C 1.511 -0.532 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.5 pt -70.82 -18.17 20.74 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.29 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -73.62 -12.57 60.79 Favored 'General case' 0 C--N 1.36 1.027 0 O-C-N 121.196 -0.94 . . . . 0.0 111.29 -177.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -95.98 -2.88 46.09 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 90.2 mt -104.27 -114.66 0.23 Allowed 'General case' 0 C--N 1.348 0.528 0 CA-C-O 121.947 0.879 . . . . 0.0 109.136 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -89.49 158.11 46.24 Favored Pre-proline 0 C--N 1.345 0.405 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -54.84 127.81 27.78 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 120.797 0.998 . . . . 0.0 112.421 176.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.08 118.92 19.34 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-O 123.163 1.459 . . . . 0.0 112.5 -175.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -84.21 160.23 57.75 Favored Pre-proline 0 N--CA 1.442 -0.829 0 CA-C-N 113.384 -1.734 . . . . 0.0 106.421 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -61.46 -22.44 74.53 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 121.727 1.618 . . . . 0.0 112.666 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -73.14 -50.47 22.48 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.514 1.126 . . . . 0.0 108.647 177.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.09 -46.27 85.79 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 125.495 1.518 . . . . 0.0 110.872 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.8 t -60.64 -42.92 93.6 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.95 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -71.84 -36.5 70.18 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 119.065 -1.054 . . . . 0.0 110.466 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.6 mt -70.8 -40.28 72.63 Favored 'General case' 0 C--N 1.368 1.402 0 O-C-N 121.62 -0.675 . . . . 0.0 110.533 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -71.65 -24.68 61.9 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.0 m -58.5 -54.19 58.56 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo . . . . . 0 C--N 1.348 0.521 0 CA-C-N 121.435 1.548 . . . . 0.0 114.748 -179.678 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.91 -61.06 8.76 Favored Pre-proline 0 C--N 1.364 1.231 0 CA-C-N 119.112 0.869 . . . . 0.0 112.738 -177.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -73.26 -18.69 23.22 Favored 'Trans proline' 0 C--N 1.351 0.692 0 CA-C-N 120.473 1.205 . . . . 0.0 115.06 -179.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -72.85 -30.7 64.21 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 121.473 -0.767 . . . . 0.0 109.517 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.05 -18.07 56.26 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.8 mt -66.07 -36.58 83.58 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.515 -0.74 . . . . 0.0 109.028 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -63.08 -37.98 89.36 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.919 -0.488 . . . . 0.0 109.865 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.41 -43.91 76.17 Favored 'General case' 0 C--N 1.361 1.091 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -56.27 -35.82 67.87 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.505 1.122 . . . . 0.0 112.09 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.87 -27.73 69.0 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.56 -0.713 . . . . 0.0 111.54 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 133.49 12.12 1.63 Allowed Glycine 0 C--N 1.354 1.572 0 C-N-CA 120.0 -1.095 . . . . 0.0 111.246 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.1 m -68.93 -43.45 75.1 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 118.817 1.309 . . . . 0.0 109.669 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 t 65.58 176.03 0.21 Allowed 'General case' 0 C--N 1.374 1.662 0 CA-C-O 121.7 0.762 . . . . 0.0 111.056 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.2 mp -139.05 125.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -151.43 125.59 9.3 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 103.016 -2.957 . . . . 0.0 103.016 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.04 -169.89 41.9 Favored Glycine 0 CA--C 1.491 -1.436 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 -178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.0 m -121.25 115.28 22.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -92.19 130.6 37.87 Favored 'General case' 0 C--N 1.357 0.913 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.99 122.34 27.17 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 122.904 1.335 . . . . 0.0 110.277 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 96.6 t -106.15 115.87 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.275 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -71.33 139.28 49.82 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.631 0.729 . . . . 0.0 109.677 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.91 -8.96 63.63 Favored Glycine 0 C--N 1.361 1.961 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -140.1 -102.85 0.53 Allowed Glycine 0 C--N 1.354 1.581 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.65 158.97 22.83 Favored Pre-proline 0 N--CA 1.448 -0.545 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.64 126.25 9.44 Favored 'Trans proline' 0 CA--C 1.513 -0.535 0 C-N-CA 121.427 1.418 . . . . 0.0 112.789 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.6 pt -109.56 136.43 45.49 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 CA-C-O 122.042 0.925 . . . . 0.0 108.793 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 61.1 m -64.66 140.84 58.91 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 122.141 0.972 . . . . 0.0 112.041 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -140.58 143.88 35.54 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.1 t -129.88 131.08 66.59 Favored 'Isoleucine or valine' 0 C--N 1.353 0.743 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.96 129.29 27.72 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 176.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -128.73 132.29 47.96 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -178.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.61 127.79 50.98 Favored 'General case' 0 C--N 1.352 0.689 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.5 m -153.59 148.35 26.42 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 103.517 -2.771 . . . . 0.0 103.517 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.65 102.91 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.216 0 CA-C-O 122.446 1.117 . . . . 0.0 111.019 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.1 p -99.03 158.58 32.05 Favored Pre-proline 0 C--N 1.354 0.765 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -49.87 155.59 4.0 Favored 'Trans proline' 0 C--O 1.203 -1.274 0 C-N-CA 122.605 2.204 . . . . 0.0 115.831 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.58 -51.15 75.99 Favored Pre-proline 0 N--CA 1.474 0.737 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.76 -4.57 15.61 Favored 'Trans proline' 0 CA--C 1.512 -0.577 0 CA-C-N 121.162 1.451 . . . . 0.0 112.15 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.93 26.15 9.87 Favored 'General case' 0 C--N 1.348 0.516 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.383 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.6 p-10 -73.02 61.94 0.6 Allowed 'General case' 0 C--N 1.374 1.633 0 CA-C-O 121.86 0.838 . . . . 0.0 111.184 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.9 mtt -117.44 153.29 33.36 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 122.003 0.906 . . . . 0.0 110.02 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.9 m -96.1 135.46 37.86 Favored 'General case' 0 C--N 1.354 0.801 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 -111.5 132.03 54.79 Favored 'General case' 0 C--N 1.36 1.06 0 CA-C-N 122.095 2.225 . . . . 0.0 109.896 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.2 t -125.62 138.72 53.93 Favored 'General case' 0 C--N 1.35 0.616 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -116.63 125.19 51.43 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.33 130.73 50.02 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -104.48 138.94 40.11 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -85.85 113.29 21.88 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 121.232 -0.917 . . . . 0.0 109.477 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.9 t30 63.24 26.64 15.25 Favored 'General case' 0 C--N 1.373 1.596 0 C-N-CA 123.584 0.754 . . . . 0.0 110.018 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 65.68 23.49 11.6 Favored 'General case' 0 C--N 1.372 1.584 0 C-N-CA 123.557 0.743 . . . . 0.0 110.978 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -92.82 115.41 28.08 Favored 'General case' 0 C--N 1.353 0.759 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.98 -24.41 67.89 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -74.29 -16.48 60.93 Favored 'General case' 0 C--N 1.362 1.112 0 O-C-N 121.342 -0.849 . . . . 0.0 109.29 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.0 mt -115.48 87.21 2.62 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.5 m -120.7 130.5 54.11 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -177.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -109.23 132.69 53.89 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -119.01 108.5 14.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 103.23 -2.878 . . . . 0.0 103.23 177.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.7 mm -120.36 119.51 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.92 141.86 46.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.48 160.66 31.45 Favored Pre-proline 0 C--O 1.238 0.467 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -53.83 151.2 26.99 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 122.246 1.964 . . . . 0.0 111.889 176.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.88 -18.02 53.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.639 -1.288 . . . . 0.0 113.312 -175.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -89.62 -28.45 19.5 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.359 -0.838 . . . . 0.0 108.89 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -92.26 -28.66 16.85 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 121.7 -0.625 . . . . 0.0 111.015 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.32 -38.75 92.15 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 121.676 -0.64 . . . . 0.0 111.591 -177.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.45 -32.89 74.54 Favored 'General case' 0 C--O 1.202 -1.426 0 O-C-N 120.488 -1.382 . . . . 0.0 109.66 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.58 -42.52 88.2 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 119.864 1.211 . . . . 0.0 109.024 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -62.65 -48.75 77.98 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.936 0.894 . . . . 0.0 110.243 175.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -43.08 99.44 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -176.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.54 -41.03 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 121.343 -0.848 . . . . 0.0 109.756 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.96 -39.6 92.69 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.925 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -63.44 -49.06 75.19 Favored 'General case' 0 C--N 1.362 1.146 0 CA-C-O 121.112 0.482 . . . . 0.0 110.945 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.3 -46.16 81.5 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-O 121.329 0.585 . . . . 0.0 110.087 -177.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -64.03 -50.44 68.46 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.636 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.91 -44.98 93.82 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.145 -0.808 . . . . 0.0 115.056 -175.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -85.06 -33.53 22.45 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 119.753 1.776 . . . . 0.0 112.226 -175.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -81.7 -49.81 10.02 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 120.878 -1.139 . . . . 0.0 111.59 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -63.56 -44.78 93.15 Favored 'General case' 0 C--N 1.362 1.119 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -86.89 -21.28 26.43 Favored 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.841 -1.162 . . . . 0.0 110.55 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 64.28 34.95 10.28 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-O 122.488 1.137 . . . . 0.0 110.452 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -117.74 139.64 50.77 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.216 -1.357 . . . . 0.0 107.403 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 14.0 m -87.35 -16.81 33.94 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.71 124.38 27.16 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -92.87 156.28 40.79 Favored Pre-proline 0 C--N 1.348 0.532 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.9 142.26 87.65 Favored 'Trans proline' 0 CA--C 1.519 -0.266 0 C-N-CA 121.632 1.554 . . . . 0.0 113.048 177.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -38.16 95.27 Favored Glycine 0 C--N 1.358 1.754 0 O-C-N 121.844 -0.535 . . . . 0.0 112.535 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.66 72.56 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.659 1.23 . . . . 0.0 109.848 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -70.42 -33.29 71.17 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.58 -19.24 62.17 Favored 'General case' 0 C--N 1.363 1.184 0 O-C-N 121.702 -0.624 . . . . 0.0 110.98 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -64.78 -43.23 93.91 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-O 122.667 1.222 . . . . 0.0 107.995 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -65.0 -40.01 94.32 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 113.378 -1.737 . . . . 0.0 111.217 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.61 -41.79 68.46 Favored 'General case' 0 C--N 1.358 0.944 0 O-C-N 121.848 -0.533 . . . . 0.0 110.462 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.4 tp -68.3 -40.51 81.73 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 122.707 0.403 . . . . 0.0 110.491 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.884 0 N-CA-C 108.022 -2.031 . . . . 0.0 108.022 -179.079 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 . . . . . 0 C--O 1.234 0.239 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.5 pt -67.67 -22.02 27.97 Favored 'Isoleucine or valine' 0 C--N 1.366 1.292 0 O-C-N 121.735 -0.603 . . . . 0.0 112.349 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -72.43 -13.38 61.43 Favored 'General case' 0 C--N 1.362 1.125 0 O-C-N 121.271 -0.893 . . . . 0.0 110.978 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -93.72 -5.62 48.03 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.9 mt -104.7 -105.37 0.3 Allowed 'General case' 0 C--N 1.352 0.694 0 CA-C-O 122.024 0.916 . . . . 0.0 109.06 -179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.5 p -89.8 151.48 45.56 Favored Pre-proline 0 C--O 1.236 0.346 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.34 125.65 19.07 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-N 119.792 0.962 . . . . 0.0 111.433 175.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.37 119.42 24.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 123.143 1.449 . . . . 0.0 112.106 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -83.88 161.8 54.47 Favored Pre-proline 0 N--CA 1.442 -0.837 0 CA-C-N 113.507 -1.679 . . . . 0.0 106.559 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -56.69 -24.72 56.3 Favored 'Trans proline' 0 N--CA 1.488 1.158 0 C-N-CA 122.381 2.054 . . . . 0.0 113.664 177.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -75.29 -52.23 11.35 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.65 -47.55 73.38 Favored 'General case' 0 C--N 1.368 1.377 0 C-N-CA 125.226 1.41 . . . . 0.0 110.767 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.05 -43.78 96.9 Favored 'Isoleucine or valine' 0 C--O 1.245 0.825 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.355 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.1 m -73.19 -36.74 66.61 Favored 'General case' 0 C--N 1.366 1.296 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.756 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.5 mt -71.45 -40.95 70.01 Favored 'General case' 0 C--N 1.365 1.276 0 O-C-N 121.649 -0.657 . . . . 0.0 110.389 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -63.79 -39.02 93.25 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.8 m -57.48 -55.22 46.79 Favored Pre-proline 0 CA--C 1.559 1.326 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo . . . . . 0 C--N 1.348 0.5 0 CA-C-N 121.597 1.606 . . . . 0.0 115.635 -178.878 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 . . . . . 0 N--CA 1.47 0.529 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.3 tp -60.53 -57.01 29.64 Favored Pre-proline 0 C--N 1.358 0.974 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -176.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -70.03 -23.08 29.96 Favored 'Trans proline' 0 CA--C 1.509 -0.729 0 CA-C-N 121.233 1.476 . . . . 0.0 114.67 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -71.25 -36.38 71.76 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.21 -17.89 60.26 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.456 -177.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.4 -19.36 63.81 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.02 -1.05 . . . . 0.0 109.902 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.4 m -84.6 -17.64 38.08 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mp -88.03 -46.12 9.61 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -57.07 -23.9 50.02 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 124.416 1.086 . . . . 0.0 112.993 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -68.47 -10.52 55.96 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 121.275 -0.891 . . . . 0.0 111.632 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.25 11.11 11.04 Favored Glycine 0 C--N 1.375 2.714 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.7 m -70.49 -43.55 69.5 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.162 0.981 . . . . 0.0 109.69 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.5 t 68.91 175.79 0.28 Allowed 'General case' 0 C--N 1.375 1.716 0 CA-C-O 121.506 0.669 . . . . 0.0 110.465 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.9 mp -137.39 126.25 34.56 Favored 'Isoleucine or valine' 0 C--N 1.361 1.079 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -150.51 126.62 10.56 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 103.242 -2.873 . . . . 0.0 103.242 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.71 -169.87 41.55 Favored Glycine 0 CA--C 1.491 -1.437 0 N-CA-C 108.387 -1.885 . . . . 0.0 108.387 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.0 p -122.16 115.4 22.35 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.3 tpt180 -92.36 129.59 38.26 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.53 128.13 33.24 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-O 123.017 1.389 . . . . 0.0 110.713 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 83.6 t -110.23 116.21 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 N-CA-C 104.122 -2.547 . . . . 0.0 104.122 177.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -73.47 134.31 43.88 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.65 58.29 Favored Glycine 0 C--N 1.363 2.03 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.94 -105.28 0.62 Allowed Glycine 0 C--N 1.353 1.523 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.9 158.27 24.07 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.98 126.06 9.09 Favored 'Trans proline' 0 CA--C 1.513 -0.552 0 C-N-CA 121.439 1.426 . . . . 0.0 112.708 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.2 135.86 45.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 CA-C-O 122.173 0.987 . . . . 0.0 108.703 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.2 m -64.85 141.21 58.85 Favored 'General case' 0 C--N 1.364 1.231 0 CA-C-O 122.189 0.995 . . . . 0.0 111.683 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -141.1 144.76 35.08 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.8 t -129.36 130.16 67.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.53 134.55 34.03 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.6 t -131.61 149.47 52.49 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-O 122.582 1.182 . . . . 0.0 109.449 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.5 116.62 19.97 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -178.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.8 p -140.74 161.56 37.49 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.66 100.67 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.355 0 CA-C-O 122.397 1.094 . . . . 0.0 109.327 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -99.69 161.44 24.42 Favored Pre-proline 0 C--N 1.355 0.826 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -53.31 155.17 12.9 Favored 'Trans proline' 0 C--O 1.208 -1.009 0 C-N-CA 122.129 1.886 . . . . 0.0 115.566 179.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.412 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 41.5 tp -49.29 -50.65 63.21 Favored Pre-proline 0 CA--C 1.546 0.798 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -177.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 65' ' ' LEU . 7.7 Cg_exo -73.33 -8.49 21.95 Favored 'Trans proline' 0 C--N 1.352 0.759 0 CA-C-N 121.204 1.466 . . . . 0.0 112.394 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.38 25.01 10.75 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.096 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -75.33 65.97 1.71 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-O 122.224 1.011 . . . . 0.0 109.066 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 72.3 mtm -120.99 153.38 37.4 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 121.86 0.838 . . . . 0.0 109.525 -177.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 60.4 m -94.44 137.24 33.82 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -115.85 129.77 56.56 Favored 'General case' 0 C--N 1.362 1.124 0 CA-C-N 122.105 2.23 . . . . 0.0 109.208 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 10.6 t -125.53 139.12 53.88 Favored 'General case' 0 C--N 1.352 0.677 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -119.71 125.59 49.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 mt -126.64 135.18 50.85 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -103.62 139.95 38.23 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.32 106.97 17.76 Favored 'General case' 0 C--N 1.344 0.358 0 O-C-N 121.259 -0.9 . . . . 0.0 109.426 -178.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.2 t30 65.52 27.35 11.66 Favored 'General case' 0 C--N 1.374 1.656 0 C-N-CA 123.654 0.782 . . . . 0.0 109.967 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 65.55 23.79 11.78 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 123.637 0.775 . . . . 0.0 110.887 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -91.73 117.66 29.96 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.24 -19.52 66.01 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -86.21 -4.88 59.26 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 121.353 -0.842 . . . . 0.0 109.727 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.4 mt -125.82 94.54 4.15 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 -178.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 81.9 p -126.07 149.63 48.75 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.067 0.936 . . . . 0.0 109.321 -176.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -127.18 132.93 50.39 Favored 'General case' 0 CA--C 1.489 -1.39 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -121.02 110.4 16.22 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 104.028 -2.582 . . . . 0.0 104.028 178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.3 mm -120.63 116.85 51.31 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.39 139.69 44.39 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.98 162.67 26.69 Favored Pre-proline 0 C--O 1.238 0.464 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 -178.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -53.25 147.81 34.47 Favored 'Trans proline' 0 N--CA 1.483 0.871 0 C-N-CA 122.372 2.048 . . . . 0.0 112.0 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -18.76 52.05 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -174.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -89.13 -27.61 20.61 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.441 -0.787 . . . . 0.0 108.955 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.69 -31.65 15.03 Favored 'General case' 0 C--N 1.356 0.885 0 O-C-N 121.769 -0.582 . . . . 0.0 111.201 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -63.71 -39.83 95.28 Favored 'General case' 0 C--N 1.36 1.027 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.59 -28.3 69.84 Favored 'General case' 0 C--N 1.365 1.249 0 O-C-N 120.492 -1.38 . . . . 0.0 110.954 -177.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.12 -40.99 87.13 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.388 0.994 . . . . 0.0 109.249 177.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . 0.511 ' HH ' ' HD3' ' A' ' 119' ' ' ARG . 20.9 m-85 -67.83 -42.98 80.64 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 123.029 0.532 . . . . 0.0 109.831 177.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -43.5 98.69 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -175.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -42.28 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 121.493 -0.754 . . . . 0.0 109.368 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -63.01 -39.7 95.55 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.276 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.26 -44.82 94.06 Favored 'General case' 0 C--N 1.364 1.202 0 O-C-N 121.76 -0.587 . . . . 0.0 110.831 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 81.4 mt -69.19 -44.52 71.99 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-O 121.412 0.625 . . . . 0.0 109.551 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.0 ttp -62.55 -48.91 77.4 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.387 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.84 -47.22 90.67 Favored Glycine 0 C--N 1.353 1.524 0 O-C-N 121.14 -0.975 . . . . 0.0 113.913 -176.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -87.85 -38.93 15.25 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-N 119.557 1.679 . . . . 0.0 113.622 -175.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -83.59 -51.64 7.13 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 120.302 -1.499 . . . . 0.0 111.794 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -64.6 -41.67 96.07 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.7 mmt -84.52 -21.16 30.65 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.967 -1.083 . . . . 0.0 110.423 -176.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 60.37 43.47 13.39 Favored 'General case' 0 C--N 1.369 1.436 0 CA-C-O 122.395 1.093 . . . . 0.0 110.753 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -134.96 144.8 47.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.922 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.68 -9.69 48.56 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -80.62 120.6 24.77 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -92.34 151.24 41.3 Favored Pre-proline 0 C--N 1.349 0.554 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -63.82 141.95 80.53 Favored 'Trans proline' 0 CA--C 1.517 -0.344 0 C-N-CA 121.721 1.614 . . . . 0.0 113.398 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.26 -37.64 94.9 Favored Glycine 0 C--N 1.357 1.743 0 O-C-N 121.862 -0.524 . . . . 0.0 112.449 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.47 -29.75 66.39 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 118.535 1.168 . . . . 0.0 109.887 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -36.45 64.96 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -69.71 -26.1 64.18 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.022 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.39 -48.54 80.76 Favored 'General case' 0 C--N 1.356 0.858 0 CA-C-O 122.133 0.968 . . . . 0.0 109.39 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.511 ' HD3' ' HH ' ' A' ' 96' ' ' TYR . 98.6 mtt180 -67.36 -42.18 83.9 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.287 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.5 -40.98 80.68 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.91 -0.494 . . . . 0.0 111.065 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 60.4 tp -67.08 -40.42 87.01 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.933 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 -179.983 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 . . . . . 0 CA--C 1.517 -0.312 0 CA-C-O 121.755 0.788 . . . . 0.0 108.969 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.3 pt -64.37 -21.29 28.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 123.546 0.738 . . . . 0.0 112.719 -178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -76.08 -8.6 57.37 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 121.131 -0.981 . . . . 0.0 111.165 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.39 -4.0 49.22 Favored 'General case' 0 C--N 1.357 0.915 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.6 mt -105.96 -112.93 0.26 Allowed 'General case' 0 C--N 1.349 0.553 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -90.01 158.3 44.57 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -54.92 128.87 32.36 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 120.813 1.009 . . . . 0.0 112.288 176.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.93 117.59 16.94 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 123.161 1.457 . . . . 0.0 112.245 -175.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -85.68 161.45 50.71 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 113.409 -1.723 . . . . 0.0 106.986 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.7 -24.57 63.77 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.49 2.127 . . . . 0.0 113.432 177.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -74.07 -52.76 11.65 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.581 1.153 . . . . 0.0 107.961 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.61 -46.23 81.02 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.287 1.435 . . . . 0.0 110.764 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.6 t -61.0 -42.71 94.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -71.26 -36.01 71.59 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.303 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.78 -40.82 75.82 Favored 'General case' 0 C--N 1.369 1.433 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -75.33 -19.4 59.64 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.914 -0.491 . . . . 0.0 112.127 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.4 m -60.55 -54.99 49.38 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -177.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo . . . . . 0 CA--C 1.512 -0.59 0 CA-C-N 121.576 1.599 . . . . 0.0 114.224 -179.543 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 CA--C 1.535 0.382 0 CA-C-O 119.883 -0.103 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -66.39 -55.03 21.2 Favored Pre-proline 0 C--N 1.367 1.351 0 O-C-N 121.283 -0.885 . . . . 0.0 112.345 -178.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -64.95 -20.25 64.14 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 120.804 1.323 . . . . 0.0 114.713 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -73.19 -29.47 62.85 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.43 -17.93 57.67 Favored 'General case' 0 C--N 1.365 1.259 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.29 -36.09 80.82 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.3 t -63.69 -38.08 89.76 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.67 -45.23 72.26 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -57.93 -37.71 74.6 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 124.65 1.18 . . . . 0.0 112.583 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.69 -10.23 25.59 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 121.305 -0.872 . . . . 0.0 112.529 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 125.39 2.49 7.56 Favored Glycine 0 C--N 1.374 2.663 0 CA-C-N 119.466 1.03 . . . . 0.0 111.889 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.0 t -68.24 -46.0 71.7 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-N 119.259 1.529 . . . . 0.0 109.828 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.31 -178.34 0.15 Allowed 'General case' 0 C--N 1.371 1.517 0 CA-C-O 121.301 0.572 . . . . 0.0 110.75 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.7 mp -140.6 125.92 19.6 Favored 'Isoleucine or valine' 0 C--N 1.363 1.191 0 CA-C-O 122.511 1.148 . . . . 0.0 108.453 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -154.03 125.71 7.63 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.41 -170.24 42.21 Favored Glycine 0 CA--C 1.492 -1.374 0 N-CA-C 108.456 -1.858 . . . . 0.0 108.456 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -119.13 112.66 19.8 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.3 tpt180 -95.66 132.49 40.79 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.04 129.8 37.4 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.959 1.362 . . . . 0.0 110.32 -178.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.1 t -114.0 119.34 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 104.177 -2.527 . . . . 0.0 104.177 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -72.61 135.95 45.62 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.419 0.628 . . . . 0.0 109.333 -178.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.41 -5.3 57.19 Favored Glycine 0 C--N 1.36 1.879 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.77 -103.5 0.38 Allowed Glycine 0 C--N 1.355 1.616 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.56 162.24 19.24 Favored Pre-proline 0 N--CA 1.447 -0.576 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -72.62 127.18 12.15 Favored 'Trans proline' 0 CA--C 1.514 -0.481 0 C-N-CA 121.161 1.24 . . . . 0.0 113.527 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 pt -110.19 137.75 41.1 Favored 'Isoleucine or valine' 0 C--N 1.358 0.963 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.9 m -64.34 140.57 58.88 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.133 0.968 . . . . 0.0 112.002 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -140.71 143.59 35.11 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -129.75 131.43 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.05 130.25 28.89 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 176.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.8 p -127.74 154.84 44.89 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-O 122.383 1.087 . . . . 0.0 109.55 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.02 132.13 46.11 Favored 'General case' 0 C--N 1.355 0.833 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.9 m -155.13 148.57 25.11 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 103.396 -2.816 . . . . 0.0 103.396 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.8 m -71.26 100.01 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 122.754 1.264 . . . . 0.0 110.134 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.1 p -100.63 163.75 17.52 Favored Pre-proline 0 C--N 1.356 0.877 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -53.29 154.66 13.97 Favored 'Trans proline' 0 C--O 1.208 -1.015 0 C-N-CA 122.037 1.825 . . . . 0.0 115.286 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.405 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 54.8 tp -50.03 -50.62 67.93 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -177.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.405 ' HD3' ' HB3' ' A' ' 65' ' ' LEU . 8.2 Cg_exo -73.04 -8.35 22.05 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.193 1.462 . . . . 0.0 112.339 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.22 24.38 11.2 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.249 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.23 70.41 2.86 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-O 122.241 1.02 . . . . 0.0 108.26 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.6 mtt -120.35 154.35 35.19 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 122.006 0.908 . . . . 0.0 110.068 -177.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 58.8 m -95.33 133.96 38.66 Favored 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.038 -2.208 . . . . 0.0 105.038 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -112.4 130.81 55.84 Favored 'General case' 0 C--N 1.359 1.016 0 CA-C-N 122.251 2.296 . . . . 0.0 109.318 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.3 t -126.08 135.82 52.18 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -115.4 124.3 50.85 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mt -126.01 125.32 42.47 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -101.78 137.59 39.89 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -86.11 113.81 22.47 Favored 'General case' 0 C--N 1.348 0.518 0 O-C-N 121.344 -0.847 . . . . 0.0 109.127 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 41.3 t30 63.89 26.29 14.22 Favored 'General case' 0 C--N 1.372 1.573 0 C-N-CA 123.475 0.71 . . . . 0.0 110.303 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 64.28 25.07 13.47 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 123.397 0.679 . . . . 0.0 111.003 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -94.8 122.52 37.51 Favored 'General case' 0 C--N 1.355 0.816 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.6 -35.65 78.46 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -70.47 -17.35 62.98 Favored 'General case' 0 C--N 1.358 0.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.523 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.9 mt -111.99 84.09 1.9 Allowed 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -122.65 131.73 53.94 Favored 'General case' 0 C--N 1.362 1.139 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -108.75 130.74 55.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -119.43 107.83 13.81 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -121.58 119.4 58.82 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.22 140.75 45.52 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -151.66 160.44 31.7 Favored Pre-proline 0 C--O 1.24 0.589 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.41 149.46 23.23 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 122.323 2.015 . . . . 0.0 111.709 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -61.84 -19.91 63.1 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 120.562 -1.336 . . . . 0.0 113.839 -174.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 49.9 p-80 -89.18 -24.52 22.14 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.34 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.01 -29.08 15.41 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.975 -0.453 . . . . 0.0 111.181 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -63.42 -38.09 89.79 Favored 'General case' 0 C--N 1.36 1.039 0 O-C-N 121.838 -0.538 . . . . 0.0 111.566 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.28 -32.58 74.07 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.652 -1.28 . . . . 0.0 109.622 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -59.21 -42.45 91.0 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 120.225 1.375 . . . . 0.0 108.974 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -63.04 -48.68 77.7 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.916 0.886 . . . . 0.0 109.994 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.26 -43.14 99.37 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.84 -44.54 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 O-C-N 121.244 -0.91 . . . . 0.0 109.753 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.75 -40.14 96.31 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.54 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttm -62.49 -50.74 70.22 Favored 'General case' 0 C--N 1.358 0.944 0 C-N-CA 122.366 0.266 . . . . 0.0 110.586 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.57 -44.17 96.98 Favored 'General case' 0 C--N 1.362 1.111 0 CA-C-O 121.546 0.689 . . . . 0.0 109.923 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 60.1 ttm -62.24 -49.02 77.41 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.479 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.41 -49.45 73.93 Favored Glycine 0 C--N 1.359 1.837 0 CA-C-O 118.952 -0.916 . . . . 0.0 115.285 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -85.89 -33.13 21.32 Favored 'General case' 0 C--N 1.363 1.19 0 CA-C-N 120.175 1.987 . . . . 0.0 113.107 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -80.85 -50.22 10.08 Favored 'General case' 0 C--N 1.354 0.786 0 O-C-N 120.449 -1.407 . . . . 0.0 111.392 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -63.82 -43.9 94.85 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -177.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.0 mtp -88.41 -17.17 31.04 Favored 'General case' 0 C--N 1.363 1.167 0 O-C-N 121.164 -0.96 . . . . 0.0 110.783 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 62.18 42.58 9.42 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-O 122.459 1.123 . . . . 0.0 110.74 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.17 144.34 45.79 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.3 -1.318 . . . . 0.0 107.895 179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 24.1 p -89.09 -14.21 36.81 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 121.112 0.482 . . . . 0.0 109.708 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -98.85 127.14 44.7 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -85.02 162.36 49.72 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -59.15 148.1 87.41 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 121.568 1.512 . . . . 0.0 113.05 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -37.45 92.13 Favored Glycine 0 C--N 1.359 1.833 0 O-C-N 121.735 -0.603 . . . . 0.0 112.869 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.45 -26.38 63.62 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 118.798 1.299 . . . . 0.0 109.955 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -75.51 -30.78 59.92 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -73.07 -17.21 61.44 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 121.42 -0.8 . . . . 0.0 110.541 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -67.61 -42.58 82.18 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-O 122.761 1.267 . . . . 0.0 107.634 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -64.03 -41.09 97.53 Favored 'General case' 0 C--N 1.357 0.903 0 CA-C-N 113.188 -1.824 . . . . 0.0 110.814 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.4 mp -71.25 -40.02 71.26 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 122.086 -0.383 . . . . 0.0 110.294 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.8 tp -67.9 -39.72 83.56 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 122.729 0.412 . . . . 0.0 109.951 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.955 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 179.577 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 . . . . . 0 C--O 1.233 0.202 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.9 pt -59.35 -19.71 16.79 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -79.39 -2.98 44.24 Favored 'General case' 0 C--N 1.365 1.264 0 CA-C-N 120.208 1.367 . . . . 0.0 110.571 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.27 -5.29 44.01 Favored 'General case' 0 C--N 1.357 0.916 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -107.1 -112.26 0.29 Allowed 'General case' 0 C--N 1.353 0.751 0 CA-C-O 121.98 0.895 . . . . 0.0 108.778 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -90.0 158.3 44.59 Favored Pre-proline 0 C--N 1.345 0.389 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -55.12 128.21 29.58 Favored 'Trans proline' 0 N--CA 1.478 0.577 0 CA-C-N 119.842 0.979 . . . . 0.0 112.257 176.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.06 117.79 18.98 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 123.119 1.437 . . . . 0.0 112.326 -175.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -85.64 160.78 52.65 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 113.487 -1.688 . . . . 0.0 106.933 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.5 -25.28 65.84 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.441 2.094 . . . . 0.0 113.513 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -74.86 -50.95 15.23 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -46.06 80.09 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 125.201 1.401 . . . . 0.0 110.586 177.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.1 t -61.24 -43.52 96.63 Favored 'Isoleucine or valine' 0 C--N 1.348 0.539 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.866 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.7 m -73.01 -34.49 66.41 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.79 -176.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -71.98 -41.04 68.15 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 121.36 -0.838 . . . . 0.0 110.26 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -70.44 -34.71 72.78 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.2 m -49.65 -51.61 58.09 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -176.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo . . . . . 0 CA--C 1.516 -0.407 0 CA-C-N 121.788 1.674 . . . . 0.0 113.196 178.625 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 111.83 0.308 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.73 -56.66 27.29 Favored Pre-proline 0 C--N 1.364 1.207 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.71 -19.31 36.55 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 120.94 1.371 . . . . 0.0 114.667 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -70.59 -37.84 73.95 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.31 -27.48 60.73 Favored 'General case' 0 C--N 1.366 1.285 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.03 -38.18 85.46 Favored 'General case' 0 C--N 1.365 1.26 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.6 m -65.4 -39.81 92.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.125 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 72.4 mt -69.07 -39.46 79.08 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 121.486 -0.759 . . . . 0.0 110.136 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -53.76 -27.05 26.41 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 125.355 1.462 . . . . 0.0 112.823 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -64.34 -11.97 37.61 Favored 'General case' 0 C--N 1.363 1.192 0 O-C-N 121.133 -0.979 . . . . 0.0 112.505 -178.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.78 -0.33 10.98 Favored Glycine 0 C--N 1.371 2.499 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.6 m -69.7 -41.65 75.13 Favored 'General case' 0 C--N 1.358 0.936 0 CA-C-N 118.241 1.021 . . . . 0.0 109.647 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 66.18 -178.89 0.2 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.558 0.695 . . . . 0.0 110.852 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.6 mp -135.79 124.88 39.7 Favored 'Isoleucine or valine' 0 C--N 1.358 0.975 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -150.06 126.65 10.91 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 103.193 -2.892 . . . . 0.0 103.193 178.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 179.17 -171.02 42.93 Favored Glycine 0 CA--C 1.492 -1.371 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -121.3 115.32 22.76 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 tpt180 -91.91 130.31 37.7 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.82 116.38 20.78 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.829 1.299 . . . . 0.0 110.478 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 91.5 t -96.91 109.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 N-CA-C 104.426 -2.435 . . . . 0.0 104.426 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -70.49 131.08 43.49 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.78 58.35 Favored Glycine 0 C--N 1.359 1.814 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -134.77 -107.88 0.96 Allowed Glycine 0 C--N 1.356 1.654 0 N-CA-C 108.604 -1.799 . . . . 0.0 108.604 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.57 158.38 25.04 Favored Pre-proline 0 N--CA 1.445 -0.699 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -178.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.58 121.62 6.46 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.179 1.253 . . . . 0.0 112.963 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 3.6 pt -108.31 136.05 45.12 Favored 'Isoleucine or valine' 0 C--N 1.358 0.978 0 CA-C-O 122.217 1.008 . . . . 0.0 108.709 -178.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.0 m -65.28 141.45 58.6 Favored 'General case' 0 C--N 1.364 1.196 0 CA-C-O 122.186 0.993 . . . . 0.0 112.099 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -141.19 145.29 35.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -129.71 130.61 66.84 Favored 'Isoleucine or valine' 0 C--N 1.351 0.664 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.56 136.06 35.65 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.2 t -135.09 152.62 51.83 Favored 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.324 1.059 . . . . 0.0 109.562 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -123.72 114.76 20.37 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 66.4 p -140.3 161.15 38.36 Favored 'General case' 0 CA--C 1.497 -1.093 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -79.6 101.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 CA-C-O 122.377 1.084 . . . . 0.0 109.835 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -99.45 161.77 23.47 Favored Pre-proline 0 C--N 1.355 0.821 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_exo -53.64 156.47 11.57 Favored 'Trans proline' 0 C--O 1.207 -1.067 0 C-N-CA 122.145 1.896 . . . . 0.0 115.772 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.8 tp -49.24 -53.54 38.38 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -73.73 -6.42 18.62 Favored 'Trans proline' 0 C--N 1.353 0.799 0 CA-C-N 121.226 1.474 . . . . 0.0 112.636 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -116.97 25.15 10.71 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.71 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 68.96 2.4 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-O 122.195 0.997 . . . . 0.0 108.555 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 59.1 mtt -125.46 152.82 44.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.925 -177.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -90.82 134.05 34.74 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -110.55 131.09 55.35 Favored 'General case' 0 C--N 1.36 1.031 0 CA-C-N 122.063 2.211 . . . . 0.0 109.726 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.1 t -124.96 136.66 53.95 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.6 123.86 49.5 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.0 131.59 52.19 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -178.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -101.71 140.42 36.02 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.119 -1.438 . . . . 0.0 107.119 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -85.86 110.7 19.58 Favored 'General case' 0 C--N 1.348 0.52 0 O-C-N 121.356 -0.84 . . . . 0.0 109.077 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.41 26.43 15.76 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 123.702 0.801 . . . . 0.0 110.595 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 67.41 21.77 9.59 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 123.604 0.762 . . . . 0.0 110.959 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -91.28 114.94 27.61 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.49 -24.71 67.62 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -74.6 -15.85 60.82 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.372 -0.83 . . . . 0.0 109.337 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.2 mt -116.04 87.49 2.69 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.4 m -120.94 130.65 53.94 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -109.11 133.15 53.38 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.64 108.76 15.33 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 103.388 -2.819 . . . . 0.0 103.388 177.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 118.67 57.41 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 -176.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.99 141.79 46.31 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -151.04 159.06 34.34 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -52.26 149.62 21.91 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 C-N-CA 122.398 2.066 . . . . 0.0 111.973 176.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.22 -19.38 54.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.784 -1.198 . . . . 0.0 113.538 -174.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -89.8 -23.74 21.65 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.306 -0.871 . . . . 0.0 109.787 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -94.39 -30.45 14.48 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 123.054 0.541 . . . . 0.0 111.357 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.82 -39.27 93.78 Favored 'General case' 0 C--N 1.361 1.1 0 O-C-N 121.901 -0.499 . . . . 0.0 112.204 -176.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.92 -32.92 74.87 Favored 'General case' 0 C--O 1.205 -1.245 0 O-C-N 120.617 -1.302 . . . . 0.0 110.12 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.21 -41.69 89.17 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 119.952 1.251 . . . . 0.0 109.26 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -62.29 -48.21 80.88 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.81 0.844 . . . . 0.0 109.765 175.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.6 -42.57 99.06 Favored 'General case' 0 C--N 1.359 1.011 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.89 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -64.14 -43.22 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 O-C-N 121.337 -0.852 . . . . 0.0 109.519 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.03 -40.3 95.27 Favored 'General case' 0 C--N 1.363 1.163 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 45.5 ttm -62.85 -49.34 75.27 Favored 'General case' 0 C--N 1.356 0.89 0 CA-C-O 120.884 0.374 . . . . 0.0 111.01 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.23 -45.96 82.56 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 121.457 0.646 . . . . 0.0 109.978 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.4 ttm -62.65 -49.83 73.59 Favored 'General case' 0 C--O 1.217 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.553 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.67 -45.17 96.35 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 121.333 -0.855 . . . . 0.0 113.962 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -86.82 -37.8 17.44 Favored 'General case' 0 C--N 1.358 0.947 0 CA-C-N 119.436 1.618 . . . . 0.0 113.008 -176.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -81.37 -50.7 9.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 120.507 -1.37 . . . . 0.0 111.877 -176.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -64.87 -42.58 94.72 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.4 mtp -84.01 -22.44 31.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.886 -1.134 . . . . 0.0 110.803 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 59.91 37.81 21.4 Favored 'General case' 0 C--N 1.369 1.425 0 CA-C-O 122.255 1.026 . . . . 0.0 110.921 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -127.83 145.88 50.79 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.591 -1.186 . . . . 0.0 108.405 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.1 t -89.06 -4.35 58.39 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.62 107.92 16.38 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -85.39 151.75 56.77 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.19 140.16 76.26 Favored 'Trans proline' 0 N--CA 1.472 0.256 0 C-N-CA 121.544 1.496 . . . . 0.0 113.37 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -37.08 93.54 Favored Glycine 0 C--N 1.357 1.725 0 O-C-N 121.88 -0.513 . . . . 0.0 112.417 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.73 -29.55 65.84 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.508 1.154 . . . . 0.0 109.69 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -72.78 -37.75 67.51 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -71.35 -24.75 62.16 Favored 'General case' 0 C--N 1.367 1.344 0 O-C-N 121.818 -0.551 . . . . 0.0 110.401 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.23 -46.5 90.17 Favored 'General case' 0 C--N 1.359 0.979 0 CA-C-O 121.953 0.882 . . . . 0.0 109.501 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -65.59 -39.58 91.73 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.748 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -43.67 77.64 Favored 'General case' 0 C--N 1.363 1.183 0 O-C-N 121.799 -0.563 . . . . 0.0 110.575 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.88 -41.25 83.08 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 122.766 0.426 . . . . 0.0 110.094 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.929 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 -179.736 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 . . . . . 0 CA--C 1.518 -0.283 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.2 tt -57.15 -24.68 21.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.352 0 C-N-CA 123.864 0.866 . . . . 0.0 112.648 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.29 -15.14 63.45 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 121.67 -0.643 . . . . 0.0 110.739 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -89.4 -5.68 57.23 Favored 'General case' 0 C--N 1.361 1.083 0 O-C-N 121.623 -0.673 . . . . 0.0 109.555 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -101.67 -104.14 0.26 Allowed 'General case' 0 C--N 1.35 0.609 0 CA-C-O 122.089 0.947 . . . . 0.0 109.108 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.3 p -89.93 153.99 47.44 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -56.78 126.56 22.64 Favored 'Trans proline' 0 C--N 1.349 0.584 0 CA-C-N 119.635 0.905 . . . . 0.0 111.259 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.26 119.05 24.09 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.399 1.571 . . . . 0.0 112.563 -175.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -84.1 164.79 42.26 Favored Pre-proline 0 N--CA 1.439 -0.99 0 CA-C-N 112.954 -1.93 . . . . 0.0 106.036 175.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -55.52 -26.94 57.01 Favored 'Trans proline' 0 N--CA 1.486 1.066 0 C-N-CA 122.133 1.888 . . . . 0.0 113.031 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.65 -51.07 25.02 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 124.498 1.119 . . . . 0.0 108.954 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.36 81.58 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.031 1.332 . . . . 0.0 111.04 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 45.6 t -61.26 -44.03 97.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.049 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 67.5 m -72.42 -36.66 68.64 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.919 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.57 -41.04 69.53 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 121.522 -0.736 . . . . 0.0 110.68 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -66.23 -36.07 82.08 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.0 m -52.58 -54.76 39.18 Favored Pre-proline 0 N--CA 1.487 1.424 0 N-CA-C 114.714 1.375 . . . . 0.0 114.714 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 CA--C 1.516 -0.419 0 CA-C-N 121.486 1.567 . . . . 0.0 114.542 179.212 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 . . . . . 0 N--CA 1.468 0.436 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.43 -56.11 38.53 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.13 -18.12 24.05 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 CA-C-N 121.201 1.465 . . . . 0.0 114.508 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -70.17 -37.26 75.12 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.32 -24.22 57.38 Favored 'General case' 0 C--N 1.359 1.015 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.69 -178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.0 mt -66.83 -38.58 86.7 Favored 'General case' 0 C--N 1.363 1.172 0 O-C-N 121.558 -0.714 . . . . 0.0 109.846 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.0 t -65.77 -41.12 92.43 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 80.2 mt -64.59 -39.95 94.65 Favored 'General case' 0 C--N 1.36 1.054 0 O-C-N 121.499 -0.751 . . . . 0.0 109.446 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.62 -21.04 15.83 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.146 1.378 . . . . 0.0 112.647 178.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -70.13 -17.55 63.2 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.262 -0.899 . . . . 0.0 111.014 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.97 5.2 7.59 Favored Glycine 0 C--N 1.359 1.827 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.9 t -69.29 -44.09 72.51 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.272 1.036 . . . . 0.0 109.099 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 67.79 178.27 0.24 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.591 0.71 . . . . 0.0 110.54 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.6 mp -135.08 123.11 39.18 Favored 'Isoleucine or valine' 0 C--N 1.358 0.954 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -150.42 126.67 10.66 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 103.272 -2.862 . . . . 0.0 103.272 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.65 -168.91 40.2 Favored Glycine 0 CA--C 1.493 -1.335 0 N-CA-C 108.292 -1.923 . . . . 0.0 108.292 -178.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.6 p -121.45 114.51 21.37 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.52 134.27 35.13 Favored 'General case' 0 C--N 1.355 0.839 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 118.62 24.12 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.746 1.26 . . . . 0.0 110.326 -176.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.2 t -98.9 108.67 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 104.281 -2.489 . . . . 0.0 104.281 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -68.9 129.75 40.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 101.74 -8.59 56.42 Favored Glycine 0 C--N 1.361 1.918 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -133.91 -107.45 0.98 Allowed Glycine 0 C--N 1.355 1.601 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.59 158.6 25.28 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 124.38 8.3 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.178 1.252 . . . . 0.0 113.035 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.8 pt -111.12 139.72 33.75 Favored 'Isoleucine or valine' 0 C--N 1.356 0.866 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.4 p -65.9 144.9 56.51 Favored 'General case' 0 C--N 1.365 1.281 0 CA-C-O 121.746 0.784 . . . . 0.0 111.974 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -142.65 143.62 32.43 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.5 t -129.56 129.61 66.81 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.09 133.87 32.15 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -132.26 151.58 51.76 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 122.445 1.117 . . . . 0.0 108.754 -178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -119.29 124.26 46.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 105.58 -2.008 . . . . 0.0 105.58 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.6 m -155.91 144.64 20.34 Favored 'General case' 0 CA--C 1.493 -1.212 0 N-CA-C 103.933 -2.618 . . . . 0.0 103.933 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.57 100.97 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-O 122.432 1.111 . . . . 0.0 110.86 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.76 156.95 34.58 Favored Pre-proline 0 C--N 1.352 0.674 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.69 152.33 1.67 Allowed 'Trans proline' 0 C--O 1.204 -1.216 0 C-N-CA 122.907 2.405 . . . . 0.0 117.029 -177.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.33 -50.9 73.49 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -176.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.07 -5.02 16.27 Favored 'Trans proline' 0 CA--C 1.511 -0.65 0 CA-C-N 121.036 1.406 . . . . 0.0 112.123 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.81 24.65 10.91 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -70.48 68.87 0.38 Allowed 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.557 0.694 . . . . 0.0 110.323 -178.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.1 mtt -124.39 153.93 41.15 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.826 0.822 . . . . 0.0 109.607 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.7 m -94.33 135.61 35.54 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 mtt85 -115.64 129.61 56.56 Favored 'General case' 0 C--N 1.361 1.079 0 CA-C-N 122.167 2.258 . . . . 0.0 109.64 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.4 t -123.33 141.23 52.2 Favored 'General case' 0 C--N 1.353 0.725 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -120.12 124.18 45.17 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -126.33 133.65 51.31 Favored 'General case' 0 C--N 1.355 0.838 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -103.88 139.56 38.89 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -86.24 112.52 21.45 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.662 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.66 25.31 15.05 Favored 'General case' 0 C--N 1.374 1.645 0 C-N-CA 123.717 0.807 . . . . 0.0 110.369 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 66.17 23.82 10.89 Favored 'General case' 0 C--N 1.371 1.509 0 C-N-CA 123.578 0.751 . . . . 0.0 110.693 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -93.44 118.17 30.99 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -18.3 65.23 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -85.59 -4.53 59.19 Favored 'General case' 0 C--N 1.357 0.934 0 O-C-N 121.211 -0.931 . . . . 0.0 109.58 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.06 95.33 4.27 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.3 p -126.05 149.6 48.75 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-O 122.115 0.959 . . . . 0.0 109.353 -176.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -126.42 132.24 51.55 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -120.82 108.29 13.76 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 103.194 -2.891 . . . . 0.0 103.194 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mm -120.51 118.93 58.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.097 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.32 142.21 45.77 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.12 159.75 33.12 Favored Pre-proline 0 C--O 1.239 0.541 0 N-CA-C 105.631 -1.988 . . . . 0.0 105.631 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -52.19 149.26 22.41 Favored 'Trans proline' 0 N--CA 1.484 0.953 0 C-N-CA 122.343 2.028 . . . . 0.0 111.502 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.21 -18.67 59.44 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.633 -1.292 . . . . 0.0 113.727 -174.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -89.7 -22.9 22.0 Favored 'General case' 0 C--N 1.355 0.822 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -94.61 -29.67 14.74 Favored 'General case' 0 C--N 1.357 0.933 0 O-C-N 121.784 -0.573 . . . . 0.0 111.134 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -64.61 -40.79 96.13 Favored 'General case' 0 C--N 1.361 1.082 0 O-C-N 121.944 -0.473 . . . . 0.0 111.857 -176.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.76 -32.83 74.6 Favored 'General case' 0 C--O 1.207 -1.183 0 O-C-N 120.461 -1.4 . . . . 0.0 110.101 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -59.52 -41.31 89.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.136 1.334 . . . . 0.0 108.893 177.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -63.2 -48.18 79.44 Favored 'General case' 0 C--N 1.351 0.671 0 C-N-CA 123.622 0.769 . . . . 0.0 110.011 175.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -42.48 96.37 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.607 0.363 . . . . 0.0 111.595 -176.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.88 -44.7 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 121.485 -0.759 . . . . 0.0 109.62 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.63 -40.86 96.35 Favored 'General case' 0 C--N 1.363 1.193 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -63.03 -49.21 75.49 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.718 0.407 . . . . 0.0 110.913 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.01 -46.41 78.05 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-O 121.631 0.729 . . . . 0.0 110.247 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttm -62.45 -49.92 73.52 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.942 -178.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.2 -44.29 97.92 Favored Glycine 0 C--N 1.358 1.79 0 CA-C-O 119.371 -0.683 . . . . 0.0 114.11 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -85.49 -38.13 18.92 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.387 1.594 . . . . 0.0 112.34 -176.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -78.39 -50.09 12.36 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 120.647 -1.283 . . . . 0.0 111.975 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -66.24 -42.34 88.75 Favored 'General case' 0 C--N 1.357 0.896 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 86.8 mtp -86.33 -22.55 26.64 Favored 'General case' 0 C--N 1.367 1.337 0 O-C-N 120.743 -1.223 . . . . 0.0 110.703 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 62.61 32.51 16.31 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-O 122.067 0.937 . . . . 0.0 111.148 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -114.41 141.74 47.27 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.3 t -86.7 -9.05 56.81 Favored 'General case' 0 C--N 1.362 1.144 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -88.41 121.99 31.42 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -87.76 153.31 52.42 Favored Pre-proline 0 C--N 1.348 0.537 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -63.17 142.1 85.46 Favored 'Trans proline' 0 CA--C 1.519 -0.249 0 C-N-CA 121.611 1.541 . . . . 0.0 113.18 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.89 -38.28 95.74 Favored Glycine 0 C--N 1.357 1.701 0 O-C-N 121.82 -0.55 . . . . 0.0 112.585 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.65 -28.6 63.87 Favored 'General case' 0 C--N 1.36 1.043 0 CA-C-N 118.723 1.262 . . . . 0.0 109.652 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -72.65 -34.11 67.04 Favored 'General case' 0 C--N 1.356 0.881 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -73.56 -24.24 60.07 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 121.194 -0.941 . . . . 0.0 110.378 -179.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -61.98 -49.94 74.08 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-O 121.378 0.608 . . . . 0.0 111.314 -178.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.05 -23.96 63.18 Favored 'General case' 0 C--N 1.363 1.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.065 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.2 mp -84.04 -42.19 16.42 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.571 -0.706 . . . . 0.0 109.33 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.0 tp -68.21 -40.45 82.14 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.226 0 N-CA-C 110.236 -1.146 . . . . 0.0 110.236 179.2 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.8 mtm . . . . . 0 N--CA 1.502 2.146 0 CA-C-O 121.635 0.731 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -142.82 162.6 35.04 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-O 121.992 0.901 . . . . 0.0 109.666 -178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.76 -19.41 25.36 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.796 -178.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -72.95 -11.08 60.44 Favored 'General case' 0 C--N 1.362 1.143 0 O-C-N 121.139 -0.976 . . . . 0.0 110.671 -178.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -93.15 -6.41 47.95 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.5 mt -103.87 -114.58 0.23 Allowed 'General case' 0 C--N 1.353 0.722 0 CA-C-O 121.942 0.877 . . . . 0.0 109.102 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -89.52 158.05 46.24 Favored Pre-proline 0 C--N 1.345 0.39 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -54.82 129.0 32.81 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 120.795 0.996 . . . . 0.0 112.181 176.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.92 117.0 14.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-O 123.415 1.579 . . . . 0.0 112.631 -175.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -85.8 160.91 51.92 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -60.42 -23.6 75.33 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 121.467 1.445 . . . . 0.0 113.01 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -73.12 -47.87 40.52 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-O 122.392 1.091 . . . . 0.0 108.601 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.35 93.32 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 125.07 1.348 . . . . 0.0 110.778 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.8 t -61.56 -44.36 98.5 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.962 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.2 p -73.21 -33.42 65.36 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 119.076 -1.05 . . . . 0.0 111.671 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.44 -38.93 71.29 Favored 'General case' 0 C--N 1.361 1.07 0 O-C-N 121.272 -0.893 . . . . 0.0 110.285 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -79.54 -13.64 59.4 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 121.921 -0.487 . . . . 0.0 111.742 179.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 17.5 m -59.19 -51.81 79.02 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 120.636 -1.29 . . . . 0.0 114.121 -177.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -66.95 124.7 12.59 Favored 'Trans proline' 0 C--N 1.349 0.572 0 CA-C-N 121.551 1.59 . . . . 0.0 114.683 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -104.89 101.86 11.42 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -83.0 128.79 34.8 Favored 'General case' 0 C--N 1.351 0.671 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.9 t -155.1 148.19 24.74 Favored 'General case' 0 C--N 1.353 0.755 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -109.76 -1.56 17.88 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -157.27 -73.51 0.09 Allowed 'General case' 0 C--N 1.363 1.172 0 O-C-N 121.258 -0.901 . . . . 0.0 109.183 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -137.0 -76.75 0.41 Allowed 'General case' 0 C--N 1.356 0.884 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -101.44 157.11 17.04 Favored 'General case' 0 C--N 1.354 0.771 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -140.87 128.17 21.05 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -68.6 -14.9 63.32 Favored 'General case' 0 C--N 1.357 0.923 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.52 -39.66 81.09 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 120.904 -1.122 . . . . 0.0 112.179 -177.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.9 tp -64.04 -54.68 38.19 Favored Pre-proline 0 C--N 1.361 1.104 0 O-C-N 121.326 -0.859 . . . . 0.0 112.82 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.97 -22.4 42.03 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.02 1.4 . . . . 0.0 114.506 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -70.86 -38.36 73.15 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.9 -33.49 68.37 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.46 -39.47 94.55 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 121.644 -0.66 . . . . 0.0 109.529 178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.7 m -64.07 -40.31 95.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.469 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 59.2 mt -69.04 -39.73 79.02 Favored 'General case' 0 C--N 1.361 1.077 0 CA-C-O 121.094 0.474 . . . . 0.0 110.016 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -51.78 -23.7 4.99 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 125.651 1.58 . . . . 0.0 113.408 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -66.91 -19.82 65.8 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.509 -0.744 . . . . 0.0 111.497 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 130.03 -0.69 5.74 Favored Glycine 0 C--N 1.359 1.844 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.3 m -66.64 -41.83 87.67 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 118.28 1.04 . . . . 0.0 109.515 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 m 65.72 177.91 0.21 Allowed 'General case' 0 C--N 1.375 1.678 0 CA-C-O 121.676 0.751 . . . . 0.0 110.848 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.0 mp -132.59 126.8 55.45 Favored 'Isoleucine or valine' 0 C--N 1.359 0.98 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -154.99 133.65 12.03 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.05 -170.22 43.33 Favored Glycine 0 CA--C 1.491 -1.425 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -120.69 114.45 21.69 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -91.53 129.07 37.57 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.21 123.15 27.68 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.915 1.341 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 92.7 t -107.2 116.47 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.24 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 177.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -72.33 136.69 46.27 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.589 0.709 . . . . 0.0 109.39 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.28 -8.1 62.4 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 110.277 -1.129 . . . . 0.0 110.277 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.8 -104.15 0.61 Allowed Glycine 0 C--N 1.354 1.561 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.14 159.16 21.37 Favored Pre-proline 0 N--CA 1.448 -0.562 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.7 124.01 7.88 Favored 'Trans proline' 0 CA--C 1.515 -0.466 0 C-N-CA 121.341 1.361 . . . . 0.0 112.818 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.52 136.15 45.07 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 CA-C-O 122.244 1.021 . . . . 0.0 108.927 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.8 m -65.02 141.47 58.75 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.165 0.983 . . . . 0.0 112.276 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -141.06 144.42 34.94 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 54.8 t -130.38 131.79 65.17 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.54 134.3 33.72 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.7 m -131.16 132.21 44.59 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 122.19 0.995 . . . . 0.0 109.099 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -113.97 132.15 56.07 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.8 t -164.17 179.19 7.05 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.91 99.93 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.297 0 CA-C-O 122.628 1.204 . . . . 0.0 109.383 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.8 t -100.59 144.53 28.67 Favored Pre-proline 0 C--N 1.354 0.779 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -49.37 149.71 8.98 Favored 'Trans proline' 0 CA--C 1.501 -1.136 0 C-N-CA 122.526 2.15 . . . . 0.0 116.334 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.0 tp -46.72 -51.06 40.12 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.27 -6.35 17.11 Favored 'Trans proline' 0 C--N 1.353 0.778 0 CA-C-N 121.44 1.55 . . . . 0.0 112.425 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.25 27.23 9.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.898 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -68.54 64.8 0.11 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-O 121.252 0.549 . . . . 0.0 110.582 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.2 mtt -125.02 152.87 43.68 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.784 0.802 . . . . 0.0 108.966 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.7 m -95.92 132.86 40.76 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -109.99 131.91 54.63 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 122.194 2.27 . . . . 0.0 109.824 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.5 t -125.08 137.45 54.2 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -115.18 125.33 53.28 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.3 129.33 47.49 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.09 138.87 39.35 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -86.02 112.3 21.1 Favored 'General case' 0 C--N 1.349 0.575 0 O-C-N 121.266 -0.896 . . . . 0.0 109.205 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.1 t30 63.83 26.69 14.41 Favored 'General case' 0 C--N 1.372 1.569 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.131 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 64.93 24.19 12.66 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 123.529 0.732 . . . . 0.0 110.895 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.63 116.15 28.75 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.59 -25.38 68.05 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -75.79 -14.15 60.3 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 121.195 -0.941 . . . . 0.0 109.613 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.9 mt -116.94 85.6 2.35 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.3 m -120.36 130.19 54.29 Favored 'General case' 0 C--N 1.361 1.106 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -109.17 132.3 54.24 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -118.5 107.88 14.32 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.8 mm -118.87 118.96 59.53 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.191 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.97 141.97 46.36 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -150.08 160.14 34.05 Favored Pre-proline 0 CA--C 1.51 -0.564 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.31 150.38 15.01 Favored 'Trans proline' 0 N--CA 1.485 0.979 0 C-N-CA 122.16 1.907 . . . . 0.0 111.716 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -62.7 -19.18 63.63 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 120.323 -1.486 . . . . 0.0 113.728 -174.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -89.1 -24.58 22.23 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.45 -29.34 16.31 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 123.124 0.57 . . . . 0.0 111.137 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.68 -39.82 94.32 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 122.035 -0.416 . . . . 0.0 111.905 -176.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -63.97 -37.53 87.74 Favored 'General case' 0 C--N 1.359 0.995 0 O-C-N 120.447 -1.408 . . . . 0.0 110.269 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -58.16 -41.36 83.63 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 120.271 1.396 . . . . 0.0 109.593 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -61.19 -48.3 82.18 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 109.952 175.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.92 -41.54 91.97 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.762 -176.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.72 -45.45 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 121.429 -0.794 . . . . 0.0 109.59 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.82 -40.8 98.49 Favored 'General case' 0 C--N 1.36 1.049 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.125 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -62.65 -47.65 82.79 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 122.635 0.374 . . . . 0.0 110.728 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.12 -44.94 82.85 Favored 'General case' 0 C--N 1.36 1.058 0 CA-C-O 121.446 0.641 . . . . 0.0 109.864 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.5 ttt -61.81 -48.73 79.3 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.482 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.14 -46.66 92.75 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 121.282 -0.886 . . . . 0.0 113.617 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -88.15 -39.22 14.71 Favored 'General case' 0 C--N 1.36 1.053 0 CA-C-N 119.328 1.564 . . . . 0.0 113.793 -176.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -83.86 -53.38 5.64 Favored 'General case' 0 C--N 1.354 0.787 0 O-C-N 120.29 -1.507 . . . . 0.0 111.983 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -62.84 -40.78 98.49 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.3 mmt -85.41 -20.69 29.45 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 121.017 -1.052 . . . . 0.0 110.833 -176.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 60.03 53.78 4.46 Favored 'General case' 0 C--N 1.366 1.316 0 CA-C-O 122.387 1.089 . . . . 0.0 111.835 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.73 155.36 38.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.5 m -109.85 55.53 0.64 Allowed 'General case' 0 C--N 1.364 1.237 0 CA-C-O 122.127 0.965 . . . . 0.0 108.677 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -132.49 115.34 15.38 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.449 -1.685 . . . . 0.0 106.449 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -85.4 144.72 40.98 Favored Pre-proline 0 C--N 1.35 0.622 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -63.77 143.79 87.24 Favored 'Trans proline' 0 CA--C 1.518 -0.28 0 C-N-CA 121.48 1.453 . . . . 0.0 112.793 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.89 96.54 Favored Glycine 0 C--N 1.355 1.627 0 O-C-N 121.743 -0.598 . . . . 0.0 112.906 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -73.17 -28.32 62.15 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.903 1.351 . . . . 0.0 109.681 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -73.34 -36.53 66.18 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -70.6 -23.14 62.51 Favored 'General case' 0 C--N 1.365 1.279 0 O-C-N 121.909 -0.494 . . . . 0.0 110.369 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -61.83 -47.0 87.03 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-O 122.189 0.995 . . . . 0.0 109.345 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -66.31 -39.32 89.21 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.649 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.07 -43.4 78.66 Favored 'General case' 0 C--N 1.364 1.203 0 O-C-N 121.826 -0.546 . . . . 0.0 110.332 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.58 -40.87 89.16 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 93.17 41.4 4.58 Favored Glycine 0 C--N 1.362 1.976 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -100.67 115.79 31.06 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 -179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -86.61 95.83 9.9 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.268 2.042 0 CA-C-O 118.084 -0.96 . . . . 0.0 109.57 179.229 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ttt . . . . . 0 N--CA 1.504 2.266 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.406 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 57.1 ttp180 -109.0 133.67 52.68 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.2 pt -61.73 -20.66 23.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.272 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.406 ' H ' ' HG2' ' A' ' 2' ' ' ARG . 98.4 m-20 -74.08 -9.91 59.09 Favored 'General case' 0 C--N 1.362 1.13 0 O-C-N 121.373 -0.829 . . . . 0.0 110.248 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -90.29 -6.9 54.61 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 80.7 mt -106.84 -108.67 0.31 Allowed 'General case' 0 C--N 1.352 0.701 0 CA-C-O 122.099 0.952 . . . . 0.0 109.253 -178.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.4 p -89.62 152.49 47.13 Favored Pre-proline 0 C--O 1.236 0.389 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -57.68 125.99 20.44 Favored 'Trans proline' 0 C--N 1.348 0.539 0 CA-C-N 119.737 0.942 . . . . 0.0 111.259 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.89 120.09 23.0 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 123.251 1.501 . . . . 0.0 112.761 -175.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -83.49 162.32 53.84 Favored Pre-proline 0 N--CA 1.443 -0.787 0 CA-C-N 113.388 -1.733 . . . . 0.0 106.403 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -55.79 -24.59 47.49 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.488 2.125 . . . . 0.0 113.692 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.6 mtt180 -75.13 -52.25 11.43 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 124.513 1.125 . . . . 0.0 108.289 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.8 77.95 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.23 1.412 . . . . 0.0 110.802 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -60.96 -44.05 97.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.565 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.17 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.3 m -72.69 -37.46 67.84 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.79 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.71 -40.64 76.17 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 121.583 -0.698 . . . . 0.0 110.297 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -71.23 -20.44 62.25 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.1 m -58.95 -54.84 52.47 Favored Pre-proline 0 N--CA 1.486 1.349 0 O-C-N 120.976 -1.078 . . . . 0.0 113.422 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.8 150.08 38.67 Favored 'Trans proline' 0 C--N 1.348 0.514 0 CA-C-N 121.323 1.508 . . . . 0.0 113.958 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -128.05 -173.24 2.88 Favored 'General case' 0 C--N 1.354 0.788 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -76.59 133.61 39.61 Favored 'General case' 0 C--N 1.357 0.906 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 49.4 m -79.18 59.21 2.71 Favored 'General case' 0 C--N 1.364 1.226 0 O-C-N 121.833 -0.542 . . . . 0.0 110.503 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -128.67 -29.25 2.4 Favored 'General case' 0 C--N 1.349 0.552 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.44 170.94 19.06 Favored 'General case' 0 C--N 1.358 0.963 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -64.05 -38.57 91.57 Favored 'General case' 0 C--N 1.365 1.279 0 N-CA-C 109.803 -0.444 . . . . 0.0 109.803 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -134.4 132.59 39.58 Favored 'General case' 0 C--N 1.354 0.765 0 N-CA-C 104.742 -2.318 . . . . 0.0 104.742 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.25 154.73 42.95 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 121.778 0.799 . . . . 0.0 109.918 -177.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 90.4 mmt-85 -66.48 -22.53 66.19 Favored 'General case' 0 C--N 1.361 1.071 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.026 -179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -70.44 -27.55 64.34 Favored 'General case' 0 C--N 1.347 0.471 0 O-C-N 121.788 -0.57 . . . . 0.0 111.286 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.439 ' HB3' ' HD3' ' A' ' 31' ' ' PRO . 46.0 tp -64.96 -56.06 23.34 Favored Pre-proline 0 C--N 1.367 1.331 0 O-C-N 121.367 -0.833 . . . . 0.0 112.431 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 30' ' ' LEU . 37.7 Cg_exo -61.52 -23.08 76.05 Favored 'Trans proline' 0 C--N 1.358 1.047 0 CA-C-N 121.185 1.459 . . . . 0.0 115.09 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -68.16 -36.26 79.37 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.96 -19.13 60.24 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 121.955 -0.466 . . . . 0.0 109.952 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.8 mt -70.77 -20.12 62.64 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 121.378 -0.827 . . . . 0.0 109.821 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.6 m -84.68 -18.25 35.92 Favored 'General case' 0 C--N 1.351 0.657 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 70.0 mt -88.38 -43.79 11.24 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -55.61 -25.68 39.95 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 124.466 1.106 . . . . 0.0 113.07 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.21 -10.5 54.9 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 121.444 -0.785 . . . . 0.0 111.892 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.58 5.64 11.03 Favored Glycine 0 C--N 1.375 2.703 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 m -71.17 -43.03 68.29 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 118.259 1.029 . . . . 0.0 109.293 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.6 t 67.33 179.77 0.22 Allowed 'General case' 0 C--N 1.374 1.656 0 CA-C-O 121.592 0.71 . . . . 0.0 110.712 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.0 mp -136.09 125.16 38.63 Favored 'Isoleucine or valine' 0 C--N 1.358 0.972 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -150.98 127.39 10.69 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 103.285 -2.857 . . . . 0.0 103.285 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -179.83 -172.36 43.77 Favored Glycine 0 CA--C 1.493 -1.313 0 N-CA-C 108.539 -1.824 . . . . 0.0 108.539 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 51.1 m -121.09 115.72 23.63 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -95.72 132.47 40.88 Favored 'General case' 0 C--N 1.355 0.812 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.25 22.52 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-O 122.663 1.22 . . . . 0.0 110.146 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 91.6 t -101.21 115.56 43.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 N-CA-C 104.334 -2.469 . . . . 0.0 104.334 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -70.61 136.56 49.26 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.52 -6.1 57.36 Favored Glycine 0 C--N 1.359 1.839 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.1 -103.38 0.4 Allowed Glycine 0 C--N 1.355 1.604 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.12 160.87 24.46 Favored Pre-proline 0 N--CA 1.448 -0.563 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -177.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.9 126.17 10.46 Favored 'Trans proline' 0 CA--C 1.513 -0.528 0 C-N-CA 121.353 1.369 . . . . 0.0 113.403 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 2.7 pt -109.47 137.42 41.69 Favored 'Isoleucine or valine' 0 C--N 1.357 0.913 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.7 m -65.84 143.93 57.16 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-O 122.078 0.942 . . . . 0.0 111.466 178.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -140.92 144.42 35.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.9 t -129.2 131.96 67.32 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 N-CA-C 106.486 -1.672 . . . . 0.0 106.486 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.64 130.15 29.63 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.5 m -128.12 131.09 49.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.505 1.145 . . . . 0.0 109.554 -177.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -110.95 124.36 51.98 Favored 'General case' 0 C--N 1.354 0.791 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.5 m -152.01 147.56 26.66 Favored 'General case' 0 CA--C 1.488 -1.413 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -71.19 100.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-O 122.694 1.235 . . . . 0.0 110.765 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.7 p -99.87 161.86 22.97 Favored Pre-proline 0 C--N 1.354 0.767 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 178.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -51.29 153.78 9.22 Favored 'Trans proline' 0 C--O 1.206 -1.122 0 C-N-CA 122.151 1.9 . . . . 0.0 115.721 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.6 tp -46.45 -54.31 19.2 Favored Pre-proline 0 CA--C 1.549 0.918 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -74.1 -6.9 19.18 Favored 'Trans proline' 0 C--N 1.353 0.77 0 CA-C-N 121.321 1.507 . . . . 0.0 112.946 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.35 24.97 10.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.333 -0.849 . . . . 0.0 108.962 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -73.63 68.91 1.24 Allowed 'General case' 0 C--N 1.379 1.877 0 CA-C-O 121.927 0.87 . . . . 0.0 109.471 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.7 mtt -120.5 154.11 35.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.916 0.865 . . . . 0.0 109.896 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 79.3 m -96.33 137.03 36.0 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 -112.69 130.16 56.15 Favored 'General case' 0 C--N 1.36 1.057 0 CA-C-N 122.261 2.301 . . . . 0.0 109.385 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.5 t -123.36 138.77 54.53 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -120.07 125.25 47.84 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.6 mt -128.43 140.24 51.94 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.5 pm0 -127.97 142.9 51.11 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 178.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -91.1 124.2 35.14 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.534 -0.729 . . . . 0.0 110.793 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 60.87 24.15 14.15 Favored 'General case' 0 C--N 1.374 1.649 0 C-N-CA 124.176 0.99 . . . . 0.0 110.995 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 63.38 26.89 15.15 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 123.344 0.658 . . . . 0.0 110.534 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -93.11 122.36 35.4 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.76 -16.16 63.72 Favored 'General case' 0 C--N 1.352 0.698 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -88.0 -2.88 58.88 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 120.863 -1.148 . . . . 0.0 109.466 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.2 mt -124.05 94.87 4.35 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 -178.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 74.2 p -128.67 151.05 49.96 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-O 121.755 0.788 . . . . 0.0 109.174 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -137.4 132.52 33.6 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.83 111.62 18.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 103.489 -2.782 . . . . 0.0 103.489 177.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.8 mm -119.3 117.82 55.38 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.985 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.2 139.63 44.67 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -152.92 162.64 25.87 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -52.55 149.27 24.56 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 C-N-CA 122.389 2.059 . . . . 0.0 112.298 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -59.52 -19.82 50.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.964 -1.085 . . . . 0.0 113.814 -174.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -88.77 -45.58 9.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -71.53 -35.45 70.69 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.197 0.599 . . . . 0.0 111.068 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -62.72 -38.99 92.67 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 123.033 0.533 . . . . 0.0 111.673 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.03 -26.38 67.49 Favored 'General case' 0 C--O 1.207 -1.18 0 O-C-N 120.286 -1.509 . . . . 0.0 110.619 -177.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.99 -40.77 97.14 Favored 'General case' 0 C--N 1.374 1.647 0 CA-C-N 119.993 1.27 . . . . 0.0 108.585 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -61.99 -47.11 86.29 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 123.935 0.894 . . . . 0.0 109.507 175.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.1 tp -60.89 -42.69 98.48 Favored 'General case' 0 C--N 1.357 0.929 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.739 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -45.95 97.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.416 -0.803 . . . . 0.0 109.653 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.71 -41.25 99.05 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.481 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 66.4 ttp -63.07 -48.7 77.5 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 122.686 0.394 . . . . 0.0 111.092 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -66.35 -45.95 78.44 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-O 121.604 0.716 . . . . 0.0 109.9 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.85 -50.33 71.35 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.157 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.12 -45.1 97.23 Favored Glycine 0 C--N 1.359 1.83 0 CA-C-O 119.123 -0.821 . . . . 0.0 115.112 -174.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -84.57 -33.59 23.38 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-N 119.827 1.813 . . . . 0.0 111.867 -176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -82.13 -49.52 10.07 Favored 'General case' 0 C--N 1.349 0.574 0 O-C-N 120.851 -1.156 . . . . 0.0 111.672 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -64.54 -43.82 92.75 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -85.22 -22.08 28.83 Favored 'General case' 0 C--N 1.367 1.33 0 O-C-N 120.684 -1.26 . . . . 0.0 110.704 -176.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 61.46 40.84 13.41 Favored 'General case' 0 C--N 1.367 1.364 0 CA-C-O 122.434 1.112 . . . . 0.0 110.461 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -125.46 147.57 49.16 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.386 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.4 p -91.06 -10.86 40.58 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -81.99 118.75 23.23 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -85.48 151.39 55.98 Favored Pre-proline 0 C--N 1.347 0.491 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -62.53 141.12 85.2 Favored 'Trans proline' 0 N--CA 1.473 0.322 0 C-N-CA 121.508 1.472 . . . . 0.0 113.078 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.6 -38.94 96.68 Favored Glycine 0 C--N 1.356 1.667 0 O-C-N 121.934 -0.478 . . . . 0.0 112.827 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.24 -29.45 63.95 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 118.811 1.305 . . . . 0.0 109.654 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.93 -35.32 67.0 Favored 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -70.75 -22.46 62.4 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 121.795 -0.566 . . . . 0.0 110.177 -178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -62.74 -45.77 91.16 Favored 'General case' 0 C--N 1.364 1.223 0 CA-C-O 122.136 0.969 . . . . 0.0 108.964 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.89 -40.21 96.85 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.809 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.62 -43.45 69.24 Favored 'General case' 0 C--N 1.358 0.978 0 O-C-N 122.065 -0.397 . . . . 0.0 110.385 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 55.6 tp -66.93 -40.67 87.66 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.834 0.454 . . . . 0.0 110.272 -179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.4 26.87 29.2 Favored Glycine 0 C--N 1.364 2.121 0 N-CA-C 110.039 -1.224 . . . . 0.0 110.039 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -97.81 116.37 29.88 Favored 'General case' 0 C--N 1.35 0.623 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -82.9 96.17 8.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 -179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 C--O 1.271 2.192 0 CA-C-O 118.101 -0.952 . . . . 0.0 109.057 178.628 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 tpp . . . . . 0 N--CA 1.504 2.247 0 CA-C-O 121.339 0.59 . . . . 0.0 111.815 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.7 ptt-85 -149.39 163.61 37.26 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.9 pt -63.49 -21.59 28.83 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -79.44 -8.92 59.46 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 121.083 -1.011 . . . . 0.0 111.041 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -101.79 -1.62 31.93 Favored 'General case' 0 C--N 1.36 1.029 0 O-C-N 121.599 -0.688 . . . . 0.0 109.499 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.9 mt -102.77 -120.45 0.19 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-O 121.966 0.888 . . . . 0.0 108.785 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -89.23 158.43 46.49 Favored Pre-proline 0 C--N 1.347 0.459 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -53.99 126.59 22.52 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 120.821 1.014 . . . . 0.0 112.617 177.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.07 118.8 18.42 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 123.2 1.476 . . . . 0.0 112.067 -176.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -84.24 160.74 56.59 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-N 113.372 -1.74 . . . . 0.0 106.909 176.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.08 -19.03 61.46 Favored 'Trans proline' 0 N--CA 1.486 1.072 0 C-N-CA 122.039 1.826 . . . . 0.0 113.416 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -76.5 -53.07 8.6 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.19 -46.59 79.33 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 125.436 1.495 . . . . 0.0 110.823 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -60.96 -42.67 93.77 Favored 'Isoleucine or valine' 0 C--N 1.349 0.576 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.9 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.3 m -71.52 -36.56 71.07 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.385 -176.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.2 mt -70.51 -40.67 73.37 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 121.656 -0.652 . . . . 0.0 110.323 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -72.42 -22.14 61.15 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -59.34 -54.58 54.78 Favored Pre-proline 0 N--CA 1.485 1.325 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.55 155.23 40.4 Favored 'Trans proline' 0 C--N 1.349 0.56 0 CA-C-N 121.308 1.503 . . . . 0.0 114.266 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.4 p90 -155.28 158.87 39.47 Favored 'General case' 0 C--N 1.35 0.626 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -91.95 67.78 5.24 Favored 'General case' 0 C--N 1.357 0.926 0 CA-C-O 121.327 0.584 . . . . 0.0 109.748 -178.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.7 t -162.5 152.48 16.3 Favored 'General case' 0 C--N 1.351 0.651 0 N-CA-C 106.668 -1.605 . . . . 0.0 106.668 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -79.37 -19.84 49.2 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -157.92 154.34 27.71 Favored 'General case' 0 C--N 1.356 0.88 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.6 t30 67.6 -121.23 0.22 Allowed 'General case' 0 C--N 1.366 1.306 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 41.8 ptt180 -160.34 163.41 33.29 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -106.87 171.18 7.51 Favored 'General case' 0 C--N 1.356 0.864 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -60.32 -27.69 67.53 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 123.726 0.81 . . . . 0.0 112.217 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -69.07 -27.7 65.86 Favored 'General case' 0 C--N 1.349 0.582 0 O-C-N 121.807 -0.558 . . . . 0.0 111.783 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.0 tp -67.14 -56.02 14.33 Favored Pre-proline 0 C--N 1.365 1.245 0 O-C-N 121.238 -0.914 . . . . 0.0 112.9 -177.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.99 -18.31 31.33 Favored 'Trans proline' 0 C--N 1.356 0.974 0 CA-C-N 121.112 1.433 . . . . 0.0 114.046 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -69.41 -36.1 76.41 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.56 -18.48 59.74 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.932 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.91 -36.18 82.67 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 121.412 -0.805 . . . . 0.0 108.905 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -64.27 -38.25 90.36 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.001 -0.437 . . . . 0.0 110.044 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mp -68.31 -43.98 76.42 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -55.01 -28.42 51.93 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 124.763 1.225 . . . . 0.0 112.602 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -65.09 -19.94 66.23 Favored 'General case' 0 C--N 1.361 1.099 0 O-C-N 121.257 -0.902 . . . . 0.0 111.064 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.23 11.21 7.58 Favored Glycine 0 C--N 1.36 1.915 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.3 m -65.73 -43.84 87.81 Favored 'General case' 0 C--N 1.361 1.088 0 CA-C-N 117.552 0.676 . . . . 0.0 109.437 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.9 m 65.28 173.94 0.21 Allowed 'General case' 0 C--N 1.375 1.675 0 CA-C-O 121.969 0.89 . . . . 0.0 111.356 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.7 mp -136.24 127.06 42.37 Favored 'Isoleucine or valine' 0 C--N 1.36 1.024 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 178.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -151.47 126.03 9.52 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 103.187 -2.894 . . . . 0.0 103.187 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.75 -169.19 41.08 Favored Glycine 0 CA--C 1.492 -1.367 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 p -121.54 115.9 23.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -92.56 130.45 38.2 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.85 118.49 22.41 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 122.874 1.321 . . . . 0.0 110.746 -176.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.4 t -99.01 109.55 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 176.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -70.31 132.5 45.78 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.59 -8.69 58.48 Favored Glycine 0 C--N 1.358 1.787 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.14 -107.12 0.9 Allowed Glycine 0 C--N 1.355 1.628 0 N-CA-C 108.668 -1.773 . . . . 0.0 108.668 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.5 157.98 24.69 Favored Pre-proline 0 N--CA 1.445 -0.697 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.78 124.95 9.12 Favored 'Trans proline' 0 CA--C 1.514 -0.508 0 C-N-CA 121.156 1.237 . . . . 0.0 112.891 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 pt -109.34 136.8 44.13 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 CA-C-O 122.055 0.931 . . . . 0.0 108.866 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.8 m -65.62 141.34 58.44 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-O 122.127 0.965 . . . . 0.0 111.918 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -140.74 144.09 35.33 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -130.49 131.89 64.9 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.35 131.96 30.8 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 66.8 p -129.56 157.88 40.84 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.31 1.053 . . . . 0.0 109.431 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -121.74 133.79 54.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 95.6 m -155.89 140.75 17.17 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.68 100.86 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-O 122.503 1.145 . . . . 0.0 109.924 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -99.54 164.44 16.61 Favored Pre-proline 0 C--N 1.354 0.786 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -52.41 155.76 9.27 Favored 'Trans proline' 0 C--O 1.206 -1.123 0 C-N-CA 122.249 1.966 . . . . 0.0 115.649 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.26 -53.66 37.25 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.04 -6.64 18.83 Favored 'Trans proline' 0 C--N 1.351 0.707 0 CA-C-N 121.247 1.481 . . . . 0.0 112.704 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.18 24.54 11.09 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.845 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.92 71.0 2.71 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -120.74 153.27 37.22 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.965 0.888 . . . . 0.0 109.976 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -95.38 135.17 37.33 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 178.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -111.11 131.32 55.18 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 121.94 2.154 . . . . 0.0 109.536 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.4 t -125.2 136.94 54.07 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.28 125.24 53.05 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.2 mt -126.55 129.18 48.09 Favored 'General case' 0 C--N 1.353 0.758 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.04 137.86 40.67 Favored 'General case' 0 C--N 1.356 0.874 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -85.79 110.04 19.08 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 121.369 -0.832 . . . . 0.0 109.667 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.0 t30 65.55 26.61 11.67 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 123.707 0.803 . . . . 0.0 109.948 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 65.08 24.1 12.48 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 123.519 0.728 . . . . 0.0 110.873 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.28 115.84 28.43 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.36 -26.08 68.25 Favored 'General case' 0 C--N 1.356 0.88 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -75.34 -14.62 60.49 Favored 'General case' 0 C--N 1.362 1.135 0 O-C-N 121.307 -0.871 . . . . 0.0 109.713 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.8 mt -116.53 84.26 2.1 Favored 'General case' 0 C--N 1.351 0.637 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.6 m -119.63 129.68 54.71 Favored 'General case' 0 C--N 1.361 1.081 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -109.39 133.17 53.4 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.58 109.29 15.99 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 103.467 -2.79 . . . . 0.0 103.467 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -119.02 117.7 55.15 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -176.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.34 140.63 45.22 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.3 mp -154.2 161.57 28.97 Favored Pre-proline 0 C--O 1.242 0.666 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 -179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -53.27 145.91 42.37 Favored 'Trans proline' 0 CA--C 1.508 -0.813 0 C-N-CA 122.059 1.839 . . . . 0.0 111.788 176.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -60.51 -20.21 59.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.084 -1.01 . . . . 0.0 113.51 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -87.95 -22.82 24.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.682 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -95.69 -33.71 12.22 Favored 'General case' 0 C--N 1.361 1.084 0 O-C-N 121.821 -0.549 . . . . 0.0 111.069 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.85 -41.22 97.57 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -175.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.7 -32.7 73.83 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 120.678 -1.264 . . . . 0.0 111.228 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.36 -41.16 79.58 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.688 1.131 . . . . 0.0 109.753 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -66.87 -41.35 87.44 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 121.698 -0.626 . . . . 0.0 109.951 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -43.05 98.97 Favored 'General case' 0 C--N 1.357 0.921 0 CA-C-O 120.525 0.202 . . . . 0.0 111.018 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -43.84 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.642 -0.661 . . . . 0.0 109.378 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.99 -40.65 96.36 Favored 'General case' 0 C--N 1.363 1.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.056 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.9 ttp -62.66 -47.92 81.57 Favored 'General case' 0 C--N 1.356 0.855 0 CA-C-O 120.995 0.426 . . . . 0.0 110.794 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.87 -44.73 80.18 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 121.516 0.674 . . . . 0.0 109.709 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -62.17 -48.64 79.16 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.293 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.73 -46.6 93.34 Favored Glycine 0 C--N 1.354 1.562 0 O-C-N 121.243 -0.911 . . . . 0.0 113.753 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -87.46 -39.28 15.35 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 119.54 1.67 . . . . 0.0 113.436 -176.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -82.51 -52.17 7.11 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.249 -1.532 . . . . 0.0 112.036 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -63.68 -41.75 98.13 Favored 'General case' 0 C--N 1.357 0.927 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 22.4 mmt -87.53 -22.72 24.69 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 121.017 -1.052 . . . . 0.0 110.714 -176.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 61.12 36.63 18.14 Favored 'General case' 0 C--N 1.366 1.31 0 CA-C-O 122.327 1.061 . . . . 0.0 110.854 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -116.16 140.37 49.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.327 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 t -89.19 -7.42 55.65 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -86.34 108.86 18.63 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -78.86 151.96 76.94 Favored Pre-proline 0 C--N 1.351 0.661 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.66 139.58 76.15 Favored 'Trans proline' 0 CA--C 1.517 -0.337 0 C-N-CA 121.668 1.579 . . . . 0.0 113.434 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.42 96.05 Favored Glycine 0 C--N 1.357 1.727 0 O-C-N 121.903 -0.498 . . . . 0.0 112.388 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.4 -34.07 75.38 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.612 1.206 . . . . 0.0 109.943 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -70.14 -40.03 75.05 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -71.21 -30.41 66.35 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 121.946 -0.471 . . . . 0.0 110.332 -178.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -60.72 -49.73 76.33 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.756 0.788 . . . . 0.0 110.05 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -67.16 -41.47 85.94 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.347 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.14 -41.27 74.1 Favored 'General case' 0 C--N 1.357 0.921 0 O-C-N 121.889 -0.507 . . . . 0.0 111.108 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.0 tp -69.71 -40.22 76.39 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 121.713 -0.617 . . . . 0.0 109.91 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.54 32.51 13.27 Favored Glycine 0 C--N 1.366 2.223 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -102.77 117.69 35.19 Favored 'General case' 0 C--N 1.351 0.662 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -82.02 96.25 7.67 Favored 'General case' 0 C--N 1.348 0.518 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 20.5 t . . . . . 0 C--O 1.269 2.123 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.236 179.499 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.9 tpt . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 121.479 0.657 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -148.85 165.31 31.89 Favored 'General case' 0 C--N 1.36 1.045 0 O-C-N 121.315 -0.866 . . . . 0.0 109.138 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.8 mm -61.47 -36.7 74.86 Favored 'Isoleucine or valine' 0 C--N 1.364 1.204 0 C-N-CA 124.088 0.955 . . . . 0.0 110.705 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -63.52 -15.06 56.87 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -176.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -91.69 -4.43 55.15 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 121.44 -0.787 . . . . 0.0 109.323 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.3 mt -106.37 -107.44 0.31 Allowed 'General case' 0 C--N 1.35 0.59 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -90.69 158.01 43.14 Favored Pre-proline 0 C--N 1.345 0.401 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -56.5 128.11 28.7 Favored 'Trans proline' 0 N--CA 1.477 0.537 0 CA-C-N 119.703 0.93 . . . . 0.0 112.416 176.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.14 119.82 24.07 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 123.138 1.447 . . . . 0.0 111.905 -176.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -83.5 162.72 52.54 Favored Pre-proline 0 N--CA 1.443 -0.805 0 CA-C-N 113.484 -1.689 . . . . 0.0 106.716 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -55.86 -26.52 58.07 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 122.361 2.04 . . . . 0.0 113.401 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -72.54 -50.52 25.1 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 108.578 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -46.01 85.37 Favored 'General case' 0 C--N 1.363 1.169 0 C-N-CA 125.612 1.565 . . . . 0.0 110.935 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -61.04 -43.24 95.76 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.685 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.9 m -71.91 -36.86 70.11 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.187 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.22 -39.1 82.45 Favored 'General case' 0 C--N 1.37 1.461 0 O-C-N 121.325 -0.859 . . . . 0.0 110.199 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -74.24 -16.27 60.96 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.817 -0.552 . . . . 0.0 112.184 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.7 m -61.8 -52.03 71.59 Favored Pre-proline 0 N--CA 1.486 1.372 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -60.96 142.6 98.03 Favored 'Trans proline' 0 N--CA 1.487 1.113 0 CA-C-N 121.553 1.59 . . . . 0.0 115.439 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -142.57 128.92 20.0 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -120.52 138.2 53.97 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.8 t -165.29 155.23 13.13 Favored 'General case' 0 C--N 1.353 0.755 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -91.9 -7.46 49.17 Favored 'General case' 0 C--N 1.358 0.935 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.77 -86.58 0.03 OUTLIER 'General case' 0 C--N 1.356 0.89 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -166.07 166.57 17.09 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 177.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 66.94 52.3 0.91 Allowed 'General case' 0 C--N 1.364 1.218 0 CA-C-O 121.992 0.901 . . . . 0.0 109.346 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -84.37 121.03 26.96 Favored 'General case' 0 C--N 1.36 1.056 0 O-C-N 121.232 -0.917 . . . . 0.0 109.009 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.7 ptt180 -64.66 -16.73 63.24 Favored 'General case' 0 C--N 1.359 1.02 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -69.11 -35.12 76.1 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 121.258 -0.901 . . . . 0.0 111.584 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.9 tp -64.1 -57.06 19.7 Favored Pre-proline 0 C--N 1.365 1.24 0 O-C-N 121.463 -0.773 . . . . 0.0 112.399 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.92 -17.26 32.45 Favored 'Trans proline' 0 C--N 1.355 0.921 0 CA-C-N 120.638 1.263 . . . . 0.0 114.957 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -68.32 -37.19 80.33 Favored 'General case' 0 C--N 1.359 1.007 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.44 -18.5 60.63 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 121.957 -0.465 . . . . 0.0 110.039 -177.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.5 mt -72.38 -22.32 61.15 Favored 'General case' 0 C--N 1.36 1.051 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 66.0 m -84.77 -25.39 28.25 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.4 mp -74.92 -41.34 59.88 Favored 'General case' 0 C--N 1.358 0.958 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.97 -29.14 59.78 Favored 'General case' 0 C--N 1.358 0.94 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.638 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -64.01 -13.32 45.83 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 121.285 -0.884 . . . . 0.0 112.79 -177.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.64 2.36 14.82 Favored Glycine 0 C--N 1.376 2.777 0 CA-C-N 119.953 1.251 . . . . 0.0 110.854 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.6 m -70.4 -42.17 72.04 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-N 118.531 1.165 . . . . 0.0 109.975 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 t 64.83 -175.9 0.17 Allowed 'General case' 0 C--N 1.372 1.572 0 CA-C-O 121.477 0.656 . . . . 0.0 110.943 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.8 mp -138.27 125.97 29.03 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -152.35 126.91 9.41 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.451 -2.796 . . . . 0.0 103.451 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.83 -169.02 40.8 Favored Glycine 0 CA--C 1.494 -1.245 0 N-CA-C 108.667 -1.773 . . . . 0.0 108.667 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.8 m -122.1 117.17 25.65 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -95.04 130.78 41.58 Favored 'General case' 0 C--N 1.355 0.807 0 N-CA-C 107.424 -1.325 . . . . 0.0 107.424 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.93 118.71 23.17 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-O 122.725 1.25 . . . . 0.0 109.8 -177.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 81.4 t -101.86 115.33 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.236 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -71.13 138.46 49.67 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.628 0.728 . . . . 0.0 109.479 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.21 -8.55 62.8 Favored Glycine 0 C--N 1.36 1.874 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.97 -103.53 0.55 Allowed Glycine 0 C--N 1.356 1.642 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.83 159.48 22.32 Favored Pre-proline 0 N--CA 1.447 -0.58 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.18 123.72 7.99 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.382 1.388 . . . . 0.0 112.84 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.4 pt -109.1 137.1 42.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.841 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 77.3 p -67.78 148.02 51.8 Favored 'General case' 0 C--N 1.364 1.206 0 CA-C-O 122.695 1.236 . . . . 0.0 112.188 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -145.8 146.52 31.21 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -129.86 130.76 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.75 135.79 35.06 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -134.99 154.1 51.85 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.406 1.098 . . . . 0.0 109.781 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.26 124.94 35.72 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.8 m -152.63 151.48 30.66 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 103.311 -2.848 . . . . 0.0 103.311 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.57 101.31 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 122.525 1.155 . . . . 0.0 111.177 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.1 p -99.25 157.34 34.21 Favored Pre-proline 0 C--N 1.352 0.717 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 176.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -50.46 151.05 10.58 Favored 'Trans proline' 0 CA--C 1.498 -1.293 0 C-N-CA 122.092 1.862 . . . . 0.0 115.586 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 tp -45.74 -52.97 22.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.01 -6.66 18.87 Favored 'Trans proline' 0 C--N 1.352 0.746 0 CA-C-N 121.582 1.601 . . . . 0.0 113.127 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.6 25.91 10.08 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 43.8 p-10 -72.67 63.41 0.6 Allowed 'General case' 0 C--N 1.374 1.635 0 CA-C-O 121.822 0.82 . . . . 0.0 111.328 -177.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -116.39 153.39 32.13 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 122.107 0.956 . . . . 0.0 110.244 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.8 m -96.72 135.8 38.14 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 104.829 -2.286 . . . . 0.0 104.829 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -113.32 132.51 55.54 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.285 2.311 . . . . 0.0 109.914 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 12.3 t -125.73 138.3 53.86 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -115.88 125.05 52.11 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 177.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.5 mt -127.07 128.15 45.82 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -104.84 135.78 45.57 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -85.99 114.3 22.77 Favored 'General case' 0 C--N 1.345 0.409 0 O-C-N 121.398 -0.814 . . . . 0.0 109.622 -177.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 63.58 25.52 14.39 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 123.825 0.85 . . . . 0.0 110.552 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 63.71 27.82 14.82 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 123.452 0.701 . . . . 0.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -96.36 114.29 25.95 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.03 -25.52 67.71 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -74.0 -16.71 61.05 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.265 -0.897 . . . . 0.0 109.416 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.7 mt -114.55 80.84 1.46 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 106.851 -1.536 . . . . 0.0 106.851 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.7 m -118.87 128.56 54.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -177.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -110.0 133.43 53.2 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -117.45 109.66 17.03 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 103.224 -2.88 . . . . 0.0 103.224 178.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.0 mm -118.82 118.74 58.79 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.165 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.14 141.57 45.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mp -150.67 160.32 32.77 Favored Pre-proline 0 CA--C 1.51 -0.562 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 -178.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -52.78 149.73 24.57 Favored 'Trans proline' 0 N--CA 1.482 0.848 0 C-N-CA 122.116 1.877 . . . . 0.0 111.273 176.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -62.35 -18.49 61.62 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.701 -1.25 . . . . 0.0 113.778 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -88.94 -22.94 22.82 Favored 'General case' 0 C--N 1.35 0.619 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -95.31 -30.13 14.11 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 122.002 -0.436 . . . . 0.0 110.772 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -64.66 -40.17 94.96 Favored 'General case' 0 C--N 1.364 1.196 0 O-C-N 121.919 -0.488 . . . . 0.0 111.62 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.28 -37.81 88.83 Favored 'General case' 0 C--N 1.36 1.041 0 O-C-N 120.355 -1.466 . . . . 0.0 109.814 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -58.98 -41.18 86.95 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 120.051 1.296 . . . . 0.0 109.487 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -61.03 -48.98 79.25 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 123.828 0.851 . . . . 0.0 109.939 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -40.94 88.16 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.021 0.528 . . . . 0.0 112.133 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.8 -46.91 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.57 -0.706 . . . . 0.0 109.851 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.77 -42.55 99.74 Favored 'General case' 0 C--N 1.359 0.994 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.395 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 64.2 ttp -63.52 -48.32 78.02 Favored 'General case' 0 C--N 1.356 0.873 0 CA-C-O 121.006 0.431 . . . . 0.0 110.859 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.6 tp -64.75 -49.16 71.88 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.367 0.603 . . . . 0.0 110.532 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.3 ttp -61.78 -50.28 72.97 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 122.834 0.453 . . . . 0.0 112.035 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.36 -44.69 97.72 Favored Glycine 0 C--N 1.359 1.812 0 CA-C-O 119.048 -0.862 . . . . 0.0 114.748 -174.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -84.6 -32.3 23.82 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.707 1.753 . . . . 0.0 112.085 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -83.47 -50.63 8.1 Favored 'General case' 0 C--N 1.35 0.592 0 O-C-N 120.79 -1.194 . . . . 0.0 111.5 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.8 ttt180 -63.37 -42.49 98.87 Favored 'General case' 0 C--N 1.358 0.97 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 38.7 mmt -82.33 -21.33 36.08 Favored 'General case' 0 C--N 1.368 1.407 0 O-C-N 120.757 -1.215 . . . . 0.0 110.395 -177.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 60.93 39.06 17.15 Favored 'General case' 0 C--N 1.369 1.427 0 CA-C-O 122.472 1.13 . . . . 0.0 110.494 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -137.32 145.69 43.72 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.033 -1.44 . . . . 0.0 107.239 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.3 m -95.83 56.34 1.72 Allowed 'General case' 0 C--N 1.358 0.939 0 CA-C-O 122.308 1.051 . . . . 0.0 108.252 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -127.09 132.95 50.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -105.55 148.15 35.87 Favored Pre-proline 0 C--N 1.349 0.582 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -65.06 141.56 70.61 Favored 'Trans proline' 0 CA--C 1.518 -0.287 0 C-N-CA 121.255 1.303 . . . . 0.0 112.191 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -39.56 97.42 Favored Glycine 0 C--N 1.357 1.731 0 O-C-N 121.818 -0.551 . . . . 0.0 112.769 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.33 -31.59 68.95 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 118.637 1.218 . . . . 0.0 109.926 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -71.16 -33.26 69.86 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -73.53 -17.46 61.2 Favored 'General case' 0 C--N 1.363 1.19 0 O-C-N 121.596 -0.69 . . . . 0.0 111.005 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -65.96 -43.01 89.18 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -64.76 -39.07 93.01 Favored 'General case' 0 C--N 1.353 0.725 0 CA-C-N 113.168 -1.833 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.12 -43.84 66.82 Favored 'General case' 0 C--N 1.359 0.983 0 O-C-N 121.839 -0.538 . . . . 0.0 110.202 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.5 tp -68.25 -40.62 81.88 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.696 0.398 . . . . 0.0 110.551 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 100.32 36.42 4.12 Favored Glycine 0 C--N 1.36 1.898 0 N-CA-C 107.918 -2.073 . . . . 0.0 107.918 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -103.32 121.85 43.6 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -82.81 95.9 8.05 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.263 1.798 0 CA-C-O 118.334 -0.841 . . . . 0.0 109.924 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.5 ttp . . . . . 0 N--CA 1.502 2.165 0 CA-C-O 121.688 0.756 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -150.29 160.0 44.04 Favored 'General case' 0 C--N 1.36 1.05 0 O-C-N 121.047 -1.033 . . . . 0.0 109.609 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.0 pt -70.5 -14.15 17.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.478 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.49 -10.47 59.82 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 121.082 -1.011 . . . . 0.0 110.168 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -91.03 -4.66 56.19 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.8 mt -107.16 -114.25 0.27 Allowed 'General case' 0 C--N 1.354 0.783 0 CA-C-O 121.851 0.834 . . . . 0.0 108.773 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -89.98 157.94 45.15 Favored Pre-proline 0 C--N 1.346 0.445 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -56.04 128.8 31.74 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 120.845 1.03 . . . . 0.0 112.283 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.86 118.5 20.95 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-O 123.309 1.528 . . . . 0.0 112.552 -175.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -84.78 161.56 52.91 Favored Pre-proline 0 N--CA 1.443 -0.81 0 CA-C-N 113.252 -1.795 . . . . 0.0 106.328 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.41 -18.18 51.86 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 122.036 1.824 . . . . 0.0 113.568 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -79.07 -52.86 7.63 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.04 1.336 . . . . 0.0 107.624 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.9 -45.93 74.76 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 125.564 1.546 . . . . 0.0 110.987 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.6 t -60.45 -41.17 86.56 Favored 'Isoleucine or valine' 0 C--N 1.351 0.66 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.242 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 60.6 m -78.85 -19.26 52.45 Favored 'General case' 0 C--N 1.365 1.252 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.794 -175.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.2 mt -83.92 -43.38 15.32 Favored 'General case' 0 C--N 1.368 1.371 0 CA-C-N 119.283 0.947 . . . . 0.0 108.615 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -65.32 -42.25 93.18 Favored 'General case' 0 C--N 1.352 0.687 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 56.5 m -53.26 -53.15 59.22 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -83.8 76.02 3.88 Favored 'Trans proline' 0 C--O 1.233 0.252 0 CA-C-N 121.551 1.59 . . . . 0.0 113.859 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.05 117.52 14.88 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-O 121.572 0.701 . . . . 0.0 109.6 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -94.25 126.35 39.45 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.5 m -152.48 136.08 16.09 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -95.49 70.63 3.1 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -172.11 -176.58 1.68 Allowed 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -97.45 13.18 30.72 Favored 'General case' 0 C--N 1.357 0.912 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.0 tpt180 -141.47 145.3 35.07 Favored 'General case' 0 C--N 1.352 0.708 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -79.84 70.95 6.47 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -77.07 -12.8 59.99 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -100.53 -17.3 17.17 Favored 'General case' 0 C--N 1.363 1.187 0 O-C-N 121.318 -0.864 . . . . 0.0 110.109 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.4 tp -62.39 -51.61 72.11 Favored Pre-proline 0 C--N 1.358 0.936 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.7 -23.01 63.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-N 121.048 1.41 . . . . 0.0 115.633 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -76.69 -28.7 55.99 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 121.359 -0.838 . . . . 0.0 108.838 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.78 -18.65 50.5 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.43 -16.95 61.3 Favored 'General case' 0 C--N 1.359 0.999 0 O-C-N 121.001 -1.062 . . . . 0.0 108.658 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.9 m -85.09 -17.19 38.12 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.7 mp -86.13 -47.67 9.3 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -67.3 -11.53 57.81 Favored 'General case' 0 C--N 1.363 1.17 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.051 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -73.11 -12.26 60.84 Favored 'General case' 0 C--N 1.362 1.109 0 O-C-N 120.749 -1.219 . . . . 0.0 109.034 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.6 10.23 9.54 Favored Glycine 0 C--N 1.377 2.85 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -71.24 -45.54 63.02 Favored 'General case' 0 C--N 1.355 0.848 0 CA-C-N 118.718 1.259 . . . . 0.0 110.935 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.5 t 66.56 177.17 0.23 Allowed 'General case' 0 C--N 1.374 1.636 0 CA-C-O 121.19 0.519 . . . . 0.0 109.795 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.6 mp -140.53 129.03 25.04 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 O-C-N 120.642 -1.287 . . . . 0.0 108.931 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -154.65 125.76 7.24 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.3 -168.74 40.65 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 108.545 -1.822 . . . . 0.0 108.545 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 p -121.15 114.92 22.13 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -93.95 131.2 39.64 Favored 'General case' 0 C--N 1.355 0.83 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.95 126.37 31.86 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.762 1.268 . . . . 0.0 109.522 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.4 t -110.46 116.85 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.0 mp0 -73.31 135.54 44.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 94.83 9.42 58.54 Favored Glycine 0 C--N 1.359 1.837 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.96 -107.89 0.26 Allowed Glycine 0 CA--C 1.492 -1.386 0 N-CA-C 109.045 -1.622 . . . . 0.0 109.045 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.4 159.19 20.59 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.93 122.55 7.31 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.32 1.347 . . . . 0.0 112.622 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.0 pt -109.97 137.27 42.99 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 CA-C-O 122.152 0.977 . . . . 0.0 108.776 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.9 m -65.19 140.76 58.79 Favored 'General case' 0 C--N 1.365 1.271 0 CA-C-O 122.143 0.973 . . . . 0.0 111.541 178.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.05 143.5 36.4 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.6 t -129.34 132.6 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -136.32 128.65 30.11 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 177.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 p -127.97 164.58 22.01 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.874 0.845 . . . . 0.0 108.779 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 65.1 p-90 -137.22 153.94 50.28 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 15.3 t -164.41 148.04 9.32 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 176.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -76.62 99.5 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 122.593 1.187 . . . . 0.0 108.994 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.1 p -99.84 160.49 27.15 Favored Pre-proline 0 C--N 1.356 0.853 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 178.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -51.79 153.46 11.41 Favored 'Trans proline' 0 CA--C 1.501 -1.128 0 C-N-CA 122.175 1.917 . . . . 0.0 115.401 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.0 tp -41.09 -54.78 5.43 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.45 -8.48 22.69 Favored 'Trans proline' 0 C--N 1.353 0.789 0 CA-C-N 121.494 1.569 . . . . 0.0 113.303 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.41 24.0 11.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.03 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.76 73.85 3.41 Favored 'General case' 0 C--N 1.375 1.704 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -123.98 153.86 40.65 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.043 0.925 . . . . 0.0 110.886 -176.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.7 m -92.84 137.84 32.01 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -115.13 129.68 56.73 Favored 'General case' 0 C--N 1.364 1.21 0 CA-C-N 122.006 2.184 . . . . 0.0 109.456 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 8.9 t -125.33 140.62 52.66 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-O 122.048 0.928 . . . . 0.0 108.714 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -118.85 124.24 46.67 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 mt -126.45 127.43 45.39 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -100.77 138.91 37.19 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 179.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -85.93 112.14 20.9 Favored 'General case' 0 C--N 1.347 0.47 0 O-C-N 121.395 -0.815 . . . . 0.0 109.113 -177.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.9 25.85 15.27 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 123.755 0.822 . . . . 0.0 110.58 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 66.44 22.48 10.71 Favored 'General case' 0 C--N 1.371 1.533 0 C-N-CA 123.555 0.742 . . . . 0.0 110.864 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -91.87 115.6 28.2 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.43 -24.98 67.72 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -75.55 -14.34 60.4 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 121.331 -0.856 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.0 mt -117.08 87.06 2.62 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -122.07 131.67 54.1 Favored 'General case' 0 C--N 1.359 1.022 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -108.54 130.56 55.28 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -118.54 107.88 14.3 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 103.082 -2.932 . . . . 0.0 103.082 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 51.3 mm -122.91 120.18 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.0 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 -175.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.81 140.12 45.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.4 mp -152.33 161.08 30.31 Favored Pre-proline 0 C--O 1.238 0.486 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -52.82 147.87 30.72 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.2 1.933 . . . . 0.0 112.571 177.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -19.27 58.11 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.926 -1.109 . . . . 0.0 112.893 -175.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.7 p-80 -89.43 -24.54 21.86 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 121.573 -0.704 . . . . 0.0 109.587 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.19 -34.42 12.92 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 121.14 0.495 . . . . 0.0 111.021 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.16 -39.32 92.26 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 123.254 0.622 . . . . 0.0 112.542 -176.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.36 -31.96 73.37 Favored 'General case' 0 C--O 1.203 -1.366 0 O-C-N 120.509 -1.37 . . . . 0.0 110.333 -177.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.34 -42.01 85.9 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 119.862 1.21 . . . . 0.0 109.425 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -61.96 -47.7 83.69 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 123.093 0.557 . . . . 0.0 109.543 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -43.55 98.38 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.712 -176.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -46.03 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 121.431 -0.793 . . . . 0.0 109.485 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.75 -42.64 97.79 Favored 'General case' 0 C--N 1.361 1.097 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.02 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.2 ttp -62.32 -50.14 72.83 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 123.166 0.586 . . . . 0.0 111.27 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -65.67 -48.02 73.5 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-O 121.397 0.618 . . . . 0.0 111.006 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mmt -63.79 -51.87 62.84 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.69 -44.87 95.75 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 -174.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -75.78 -36.84 59.67 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 119.37 1.585 . . . . 0.0 110.738 -176.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -73.78 -45.15 53.45 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 121.793 -0.567 . . . . 0.0 110.845 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -65.35 -46.28 80.82 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.8 mtm -85.4 -22.34 28.42 Favored 'General case' 0 C--N 1.367 1.347 0 O-C-N 120.811 -1.181 . . . . 0.0 111.194 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 60.11 38.64 20.31 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-O 122.338 1.066 . . . . 0.0 110.752 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -137.18 139.52 41.17 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.2 m -94.45 56.31 2.1 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -137.41 108.36 6.71 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.65 154.8 39.81 Favored Pre-proline 0 C--N 1.354 0.764 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -59.96 146.61 95.5 Favored 'Trans proline' 0 N--CA 1.475 0.413 0 C-N-CA 122.027 1.818 . . . . 0.0 113.696 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -66.33 -16.6 65.13 Favored Glycine 0 C--N 1.361 1.966 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.949 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.2 -33.45 73.35 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-N 119.125 1.463 . . . . 0.0 109.3 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -72.6 -34.75 67.61 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -72.26 -23.72 61.25 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.947 -0.47 . . . . 0.0 110.306 -178.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -63.78 -50.45 68.97 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-O 122.122 0.963 . . . . 0.0 109.322 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -67.58 -40.31 84.83 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.193 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -40.15 82.29 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 122.473 0.309 . . . . 0.0 110.863 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 58.4 tp -68.86 -40.93 79.05 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 121.608 -0.683 . . . . 0.0 109.755 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 94.68 13.51 53.23 Favored Glycine 0 C--N 1.366 2.204 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -102.37 116.35 32.45 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -79.71 96.27 6.19 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.3 t . . . . . 0 C--O 1.263 1.811 0 CA-C-O 118.405 -0.807 . . . . 0.0 109.449 178.717 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.3 ttm . . . . . 0 N--CA 1.503 2.223 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -151.66 159.14 44.15 Favored 'General case' 0 C--N 1.355 0.836 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.5 pt -70.82 -18.17 20.74 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.29 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -73.62 -12.57 60.79 Favored 'General case' 0 C--N 1.36 1.027 0 O-C-N 121.196 -0.94 . . . . 0.0 111.29 -177.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -95.98 -2.88 46.09 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 90.2 mt -104.27 -114.66 0.23 Allowed 'General case' 0 C--N 1.348 0.528 0 CA-C-O 121.947 0.879 . . . . 0.0 109.136 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -89.49 158.11 46.24 Favored Pre-proline 0 C--N 1.345 0.405 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -54.84 127.81 27.78 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 120.797 0.998 . . . . 0.0 112.421 176.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.08 118.92 19.34 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-O 123.163 1.459 . . . . 0.0 112.5 -175.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -84.21 160.23 57.75 Favored Pre-proline 0 N--CA 1.442 -0.829 0 CA-C-N 113.384 -1.734 . . . . 0.0 106.421 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -61.46 -22.44 74.53 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 121.727 1.618 . . . . 0.0 112.666 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -73.14 -50.47 22.48 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.514 1.126 . . . . 0.0 108.647 177.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.09 -46.27 85.79 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 125.495 1.518 . . . . 0.0 110.872 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.8 t -60.64 -42.92 93.6 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.95 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -71.84 -36.5 70.18 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 119.065 -1.054 . . . . 0.0 110.466 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.6 mt -70.8 -40.28 72.63 Favored 'General case' 0 C--N 1.368 1.402 0 O-C-N 121.62 -0.675 . . . . 0.0 110.533 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -71.65 -24.68 61.9 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.0 m -58.5 -54.19 58.56 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.67 148.78 42.35 Favored 'Trans proline' 0 C--N 1.348 0.521 0 CA-C-N 121.435 1.548 . . . . 0.0 114.748 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -157.2 165.12 36.83 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -79.92 109.02 13.95 Favored 'General case' 0 C--N 1.354 0.802 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 67.5 m -86.39 60.72 6.4 Favored 'General case' 0 C--N 1.358 0.97 0 O-C-N 121.537 -0.727 . . . . 0.0 109.543 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -98.45 -19.16 17.85 Favored 'General case' 0 C--N 1.356 0.852 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.31 173.86 15.6 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -63.49 -38.65 91.94 Favored 'General case' 0 C--N 1.364 1.224 0 CA-C-O 120.593 0.235 . . . . 0.0 110.46 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -122.97 137.67 54.89 Favored 'General case' 0 C--N 1.354 0.794 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -116.31 128.66 55.75 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.4 mmm180 -62.58 -37.21 85.3 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 123.02 0.528 . . . . 0.0 111.681 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -67.0 -26.33 66.74 Favored 'General case' 0 C--N 1.351 0.645 0 O-C-N 121.496 -0.753 . . . . 0.0 112.473 -178.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.91 -61.06 8.76 Favored Pre-proline 0 C--N 1.364 1.231 0 CA-C-N 119.112 0.869 . . . . 0.0 112.738 -177.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -73.26 -18.69 23.22 Favored 'Trans proline' 0 C--N 1.351 0.692 0 CA-C-N 120.473 1.205 . . . . 0.0 115.06 -179.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -72.85 -30.7 64.21 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 121.473 -0.767 . . . . 0.0 109.517 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.05 -18.07 56.26 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.8 mt -66.07 -36.58 83.58 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.515 -0.74 . . . . 0.0 109.028 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -63.08 -37.98 89.36 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.919 -0.488 . . . . 0.0 109.865 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.41 -43.91 76.17 Favored 'General case' 0 C--N 1.361 1.091 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -56.27 -35.82 67.87 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.505 1.122 . . . . 0.0 112.09 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.87 -27.73 69.0 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.56 -0.713 . . . . 0.0 111.54 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 133.49 12.12 1.63 Allowed Glycine 0 C--N 1.354 1.572 0 C-N-CA 120.0 -1.095 . . . . 0.0 111.246 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.1 m -68.93 -43.45 75.1 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 118.817 1.309 . . . . 0.0 109.669 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 t 65.58 176.03 0.21 Allowed 'General case' 0 C--N 1.374 1.662 0 CA-C-O 121.7 0.762 . . . . 0.0 111.056 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.2 mp -139.05 125.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -151.43 125.59 9.3 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 103.016 -2.957 . . . . 0.0 103.016 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.04 -169.89 41.9 Favored Glycine 0 CA--C 1.491 -1.436 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 -178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.0 m -121.25 115.28 22.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -92.19 130.6 37.87 Favored 'General case' 0 C--N 1.357 0.913 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.99 122.34 27.17 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 122.904 1.335 . . . . 0.0 110.277 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 96.6 t -106.15 115.87 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.275 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -71.33 139.28 49.82 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.631 0.729 . . . . 0.0 109.677 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.91 -8.96 63.63 Favored Glycine 0 C--N 1.361 1.961 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -140.1 -102.85 0.53 Allowed Glycine 0 C--N 1.354 1.581 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.65 158.97 22.83 Favored Pre-proline 0 N--CA 1.448 -0.545 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.64 126.25 9.44 Favored 'Trans proline' 0 CA--C 1.513 -0.535 0 C-N-CA 121.427 1.418 . . . . 0.0 112.789 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.6 pt -109.56 136.43 45.49 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 CA-C-O 122.042 0.925 . . . . 0.0 108.793 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 61.1 m -64.66 140.84 58.91 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 122.141 0.972 . . . . 0.0 112.041 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -140.58 143.88 35.54 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.1 t -129.88 131.08 66.59 Favored 'Isoleucine or valine' 0 C--N 1.353 0.743 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.96 129.29 27.72 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 176.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -128.73 132.29 47.96 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -178.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.61 127.79 50.98 Favored 'General case' 0 C--N 1.352 0.689 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.5 m -153.59 148.35 26.42 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 103.517 -2.771 . . . . 0.0 103.517 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.65 102.91 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.216 0 CA-C-O 122.446 1.117 . . . . 0.0 111.019 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.1 p -99.03 158.58 32.05 Favored Pre-proline 0 C--N 1.354 0.765 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -49.87 155.59 4.0 Favored 'Trans proline' 0 C--O 1.203 -1.274 0 C-N-CA 122.605 2.204 . . . . 0.0 115.831 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.58 -51.15 75.99 Favored Pre-proline 0 N--CA 1.474 0.737 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.76 -4.57 15.61 Favored 'Trans proline' 0 CA--C 1.512 -0.577 0 CA-C-N 121.162 1.451 . . . . 0.0 112.15 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.93 26.15 9.87 Favored 'General case' 0 C--N 1.348 0.516 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.383 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.6 p-10 -73.02 61.94 0.6 Allowed 'General case' 0 C--N 1.374 1.633 0 CA-C-O 121.86 0.838 . . . . 0.0 111.184 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.9 mtt -117.44 153.29 33.36 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 122.003 0.906 . . . . 0.0 110.02 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.9 m -96.1 135.46 37.86 Favored 'General case' 0 C--N 1.354 0.801 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 -111.5 132.03 54.79 Favored 'General case' 0 C--N 1.36 1.06 0 CA-C-N 122.095 2.225 . . . . 0.0 109.896 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.2 t -125.62 138.72 53.93 Favored 'General case' 0 C--N 1.35 0.616 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -116.63 125.19 51.43 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.33 130.73 50.02 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -104.48 138.94 40.11 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -85.85 113.29 21.88 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 121.232 -0.917 . . . . 0.0 109.477 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.9 t30 63.24 26.64 15.25 Favored 'General case' 0 C--N 1.373 1.596 0 C-N-CA 123.584 0.754 . . . . 0.0 110.018 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 65.68 23.49 11.6 Favored 'General case' 0 C--N 1.372 1.584 0 C-N-CA 123.557 0.743 . . . . 0.0 110.978 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -92.82 115.41 28.08 Favored 'General case' 0 C--N 1.353 0.759 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.98 -24.41 67.89 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -74.29 -16.48 60.93 Favored 'General case' 0 C--N 1.362 1.112 0 O-C-N 121.342 -0.849 . . . . 0.0 109.29 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.0 mt -115.48 87.21 2.62 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.5 m -120.7 130.5 54.11 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -177.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -109.23 132.69 53.89 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -119.01 108.5 14.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 103.23 -2.878 . . . . 0.0 103.23 177.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.7 mm -120.36 119.51 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.92 141.86 46.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.48 160.66 31.45 Favored Pre-proline 0 C--O 1.238 0.467 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -53.83 151.2 26.99 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 122.246 1.964 . . . . 0.0 111.889 176.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.88 -18.02 53.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.639 -1.288 . . . . 0.0 113.312 -175.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -89.62 -28.45 19.5 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.359 -0.838 . . . . 0.0 108.89 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -92.26 -28.66 16.85 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 121.7 -0.625 . . . . 0.0 111.015 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.32 -38.75 92.15 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 121.676 -0.64 . . . . 0.0 111.591 -177.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.45 -32.89 74.54 Favored 'General case' 0 C--O 1.202 -1.426 0 O-C-N 120.488 -1.382 . . . . 0.0 109.66 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.58 -42.52 88.2 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 119.864 1.211 . . . . 0.0 109.024 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -62.65 -48.75 77.98 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.936 0.894 . . . . 0.0 110.243 175.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -43.08 99.44 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -176.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.54 -41.03 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 121.343 -0.848 . . . . 0.0 109.756 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.96 -39.6 92.69 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.925 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -63.44 -49.06 75.19 Favored 'General case' 0 C--N 1.362 1.146 0 CA-C-O 121.112 0.482 . . . . 0.0 110.945 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.3 -46.16 81.5 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-O 121.329 0.585 . . . . 0.0 110.087 -177.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -64.03 -50.44 68.46 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.636 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.91 -44.98 93.82 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.145 -0.808 . . . . 0.0 115.056 -175.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -85.06 -33.53 22.45 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 119.753 1.776 . . . . 0.0 112.226 -175.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -81.7 -49.81 10.02 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 120.878 -1.139 . . . . 0.0 111.59 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -63.56 -44.78 93.15 Favored 'General case' 0 C--N 1.362 1.119 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -86.89 -21.28 26.43 Favored 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.841 -1.162 . . . . 0.0 110.55 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 64.28 34.95 10.28 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-O 122.488 1.137 . . . . 0.0 110.452 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -117.74 139.64 50.77 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.216 -1.357 . . . . 0.0 107.403 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 14.0 m -87.35 -16.81 33.94 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.71 124.38 27.16 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -92.87 156.28 40.79 Favored Pre-proline 0 C--N 1.348 0.532 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.9 142.26 87.65 Favored 'Trans proline' 0 CA--C 1.519 -0.266 0 C-N-CA 121.632 1.554 . . . . 0.0 113.048 177.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -38.16 95.27 Favored Glycine 0 C--N 1.358 1.754 0 O-C-N 121.844 -0.535 . . . . 0.0 112.535 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.66 72.56 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.659 1.23 . . . . 0.0 109.848 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -70.42 -33.29 71.17 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.58 -19.24 62.17 Favored 'General case' 0 C--N 1.363 1.184 0 O-C-N 121.702 -0.624 . . . . 0.0 110.98 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -64.78 -43.23 93.91 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-O 122.667 1.222 . . . . 0.0 107.995 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -65.0 -40.01 94.32 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 113.378 -1.737 . . . . 0.0 111.217 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.61 -41.79 68.46 Favored 'General case' 0 C--N 1.358 0.944 0 O-C-N 121.848 -0.533 . . . . 0.0 110.462 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.4 tp -68.3 -40.51 81.73 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 122.707 0.403 . . . . 0.0 110.491 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 101.73 34.91 4.21 Favored Glycine 0 C--N 1.36 1.884 0 N-CA-C 108.022 -2.031 . . . . 0.0 108.022 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -103.09 121.39 42.52 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -84.16 96.08 8.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.266 1.927 0 CA-C-O 118.164 -0.922 . . . . 0.0 109.881 -179.936 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.5 ttp . . . . . 0 N--CA 1.509 2.496 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -87.23 123.67 32.49 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.5 pt -67.67 -22.02 27.97 Favored 'Isoleucine or valine' 0 C--N 1.366 1.292 0 O-C-N 121.735 -0.603 . . . . 0.0 112.349 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -72.43 -13.38 61.43 Favored 'General case' 0 C--N 1.362 1.125 0 O-C-N 121.271 -0.893 . . . . 0.0 110.978 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -93.72 -5.62 48.03 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.9 mt -104.7 -105.37 0.3 Allowed 'General case' 0 C--N 1.352 0.694 0 CA-C-O 122.024 0.916 . . . . 0.0 109.06 -179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.5 p -89.8 151.48 45.56 Favored Pre-proline 0 C--O 1.236 0.346 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.34 125.65 19.07 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-N 119.792 0.962 . . . . 0.0 111.433 175.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.37 119.42 24.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 123.143 1.449 . . . . 0.0 112.106 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -83.88 161.8 54.47 Favored Pre-proline 0 N--CA 1.442 -0.837 0 CA-C-N 113.507 -1.679 . . . . 0.0 106.559 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -56.69 -24.72 56.3 Favored 'Trans proline' 0 N--CA 1.488 1.158 0 C-N-CA 122.381 2.054 . . . . 0.0 113.664 177.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -75.29 -52.23 11.35 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.65 -47.55 73.38 Favored 'General case' 0 C--N 1.368 1.377 0 C-N-CA 125.226 1.41 . . . . 0.0 110.767 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.05 -43.78 96.9 Favored 'Isoleucine or valine' 0 C--O 1.245 0.825 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.355 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.1 m -73.19 -36.74 66.61 Favored 'General case' 0 C--N 1.366 1.296 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.756 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.5 mt -71.45 -40.95 70.01 Favored 'General case' 0 C--N 1.365 1.276 0 O-C-N 121.649 -0.657 . . . . 0.0 110.389 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -63.79 -39.02 93.25 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.8 m -57.48 -55.22 46.79 Favored Pre-proline 0 CA--C 1.559 1.326 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -86.48 77.54 2.26 Favored 'Trans proline' 0 C--N 1.348 0.5 0 CA-C-N 121.597 1.606 . . . . 0.0 115.635 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -124.11 151.27 44.1 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -170.16 -174.37 1.72 Allowed 'General case' 0 C--N 1.354 0.763 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.4 t -153.3 156.94 39.34 Favored 'General case' 0 C--N 1.352 0.681 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -83.62 69.58 10.15 Favored 'General case' 0 C--N 1.357 0.92 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -158.77 -78.29 0.07 Allowed 'General case' 0 C--N 1.352 0.692 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.84 -54.33 0.02 OUTLIER 'General case' 0 C--N 1.358 0.97 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.2 mtp180 -90.89 162.03 14.96 Favored 'General case' 0 C--N 1.358 0.96 0 CA-C-O 121.635 0.731 . . . . 0.0 109.078 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -83.14 75.63 9.91 Favored 'General case' 0 C--N 1.361 1.093 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mmt180 -63.45 -40.58 97.52 Favored 'General case' 0 C--N 1.354 0.794 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -73.96 -21.37 60.04 Favored 'General case' 0 C--N 1.355 0.835 0 O-C-N 121.243 -0.91 . . . . 0.0 112.663 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.3 tp -60.53 -57.01 29.64 Favored Pre-proline 0 C--N 1.358 0.974 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -176.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -70.03 -23.08 29.96 Favored 'Trans proline' 0 CA--C 1.509 -0.729 0 CA-C-N 121.233 1.476 . . . . 0.0 114.67 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -71.25 -36.38 71.76 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.21 -17.89 60.26 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.456 -177.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.4 -19.36 63.81 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.02 -1.05 . . . . 0.0 109.902 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.4 m -84.6 -17.64 38.08 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.5 mp -88.03 -46.12 9.61 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -57.07 -23.9 50.02 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 124.416 1.086 . . . . 0.0 112.993 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -68.47 -10.52 55.96 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 121.275 -0.891 . . . . 0.0 111.632 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.25 11.11 11.04 Favored Glycine 0 C--N 1.375 2.714 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.7 m -70.49 -43.55 69.5 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.162 0.981 . . . . 0.0 109.69 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.5 t 68.91 175.79 0.28 Allowed 'General case' 0 C--N 1.375 1.716 0 CA-C-O 121.506 0.669 . . . . 0.0 110.465 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.9 mp -137.39 126.25 34.56 Favored 'Isoleucine or valine' 0 C--N 1.361 1.079 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -150.51 126.62 10.56 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 103.242 -2.873 . . . . 0.0 103.242 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.71 -169.87 41.55 Favored Glycine 0 CA--C 1.491 -1.437 0 N-CA-C 108.387 -1.885 . . . . 0.0 108.387 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.0 p -122.16 115.4 22.35 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.3 tpt180 -92.36 129.59 38.26 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.53 128.13 33.24 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-O 123.017 1.389 . . . . 0.0 110.713 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 83.6 t -110.23 116.21 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 N-CA-C 104.122 -2.547 . . . . 0.0 104.122 177.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -73.47 134.31 43.88 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.65 58.29 Favored Glycine 0 C--N 1.363 2.03 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.94 -105.28 0.62 Allowed Glycine 0 C--N 1.353 1.523 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.9 158.27 24.07 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.98 126.06 9.09 Favored 'Trans proline' 0 CA--C 1.513 -0.552 0 C-N-CA 121.439 1.426 . . . . 0.0 112.708 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.2 135.86 45.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 CA-C-O 122.173 0.987 . . . . 0.0 108.703 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.2 m -64.85 141.21 58.85 Favored 'General case' 0 C--N 1.364 1.231 0 CA-C-O 122.189 0.995 . . . . 0.0 111.683 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -141.1 144.76 35.08 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.8 t -129.36 130.16 67.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.53 134.55 34.03 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.6 t -131.61 149.47 52.49 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-O 122.582 1.182 . . . . 0.0 109.449 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.5 116.62 19.97 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -178.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.8 p -140.74 161.56 37.49 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.66 100.67 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.355 0 CA-C-O 122.397 1.094 . . . . 0.0 109.327 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -99.69 161.44 24.42 Favored Pre-proline 0 C--N 1.355 0.826 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -53.31 155.17 12.9 Favored 'Trans proline' 0 C--O 1.208 -1.009 0 C-N-CA 122.129 1.886 . . . . 0.0 115.566 179.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.412 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 41.5 tp -49.29 -50.65 63.21 Favored Pre-proline 0 CA--C 1.546 0.798 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -177.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 65' ' ' LEU . 7.7 Cg_exo -73.33 -8.49 21.95 Favored 'Trans proline' 0 C--N 1.352 0.759 0 CA-C-N 121.204 1.466 . . . . 0.0 112.394 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.38 25.01 10.75 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.096 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -75.33 65.97 1.71 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-O 122.224 1.011 . . . . 0.0 109.066 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 72.3 mtm -120.99 153.38 37.4 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 121.86 0.838 . . . . 0.0 109.525 -177.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 60.4 m -94.44 137.24 33.82 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -115.85 129.77 56.56 Favored 'General case' 0 C--N 1.362 1.124 0 CA-C-N 122.105 2.23 . . . . 0.0 109.208 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 10.6 t -125.53 139.12 53.88 Favored 'General case' 0 C--N 1.352 0.677 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -119.71 125.59 49.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 mt -126.64 135.18 50.85 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -103.62 139.95 38.23 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.32 106.97 17.76 Favored 'General case' 0 C--N 1.344 0.358 0 O-C-N 121.259 -0.9 . . . . 0.0 109.426 -178.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.2 t30 65.52 27.35 11.66 Favored 'General case' 0 C--N 1.374 1.656 0 C-N-CA 123.654 0.782 . . . . 0.0 109.967 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 65.55 23.79 11.78 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 123.637 0.775 . . . . 0.0 110.887 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -91.73 117.66 29.96 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.24 -19.52 66.01 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -86.21 -4.88 59.26 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 121.353 -0.842 . . . . 0.0 109.727 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.4 mt -125.82 94.54 4.15 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 -178.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 81.9 p -126.07 149.63 48.75 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.067 0.936 . . . . 0.0 109.321 -176.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -127.18 132.93 50.39 Favored 'General case' 0 CA--C 1.489 -1.39 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -121.02 110.4 16.22 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 104.028 -2.582 . . . . 0.0 104.028 178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.3 mm -120.63 116.85 51.31 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.39 139.69 44.39 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.98 162.67 26.69 Favored Pre-proline 0 C--O 1.238 0.464 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 -178.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -53.25 147.81 34.47 Favored 'Trans proline' 0 N--CA 1.483 0.871 0 C-N-CA 122.372 2.048 . . . . 0.0 112.0 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -18.76 52.05 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -174.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -89.13 -27.61 20.61 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.441 -0.787 . . . . 0.0 108.955 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.69 -31.65 15.03 Favored 'General case' 0 C--N 1.356 0.885 0 O-C-N 121.769 -0.582 . . . . 0.0 111.201 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -63.71 -39.83 95.28 Favored 'General case' 0 C--N 1.36 1.027 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.59 -28.3 69.84 Favored 'General case' 0 C--N 1.365 1.249 0 O-C-N 120.492 -1.38 . . . . 0.0 110.954 -177.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.12 -40.99 87.13 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.388 0.994 . . . . 0.0 109.249 177.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . 0.511 ' HH ' ' HD3' ' A' ' 119' ' ' ARG . 20.9 m-85 -67.83 -42.98 80.64 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 123.029 0.532 . . . . 0.0 109.831 177.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -43.5 98.69 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -175.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -42.28 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 121.493 -0.754 . . . . 0.0 109.368 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -63.01 -39.7 95.55 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.276 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.26 -44.82 94.06 Favored 'General case' 0 C--N 1.364 1.202 0 O-C-N 121.76 -0.587 . . . . 0.0 110.831 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 81.4 mt -69.19 -44.52 71.99 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-O 121.412 0.625 . . . . 0.0 109.551 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.0 ttp -62.55 -48.91 77.4 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.387 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.84 -47.22 90.67 Favored Glycine 0 C--N 1.353 1.524 0 O-C-N 121.14 -0.975 . . . . 0.0 113.913 -176.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -87.85 -38.93 15.25 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-N 119.557 1.679 . . . . 0.0 113.622 -175.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -83.59 -51.64 7.13 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 120.302 -1.499 . . . . 0.0 111.794 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -64.6 -41.67 96.07 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.7 mmt -84.52 -21.16 30.65 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.967 -1.083 . . . . 0.0 110.423 -176.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 60.37 43.47 13.39 Favored 'General case' 0 C--N 1.369 1.436 0 CA-C-O 122.395 1.093 . . . . 0.0 110.753 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -134.96 144.8 47.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.922 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.68 -9.69 48.56 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -80.62 120.6 24.77 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -92.34 151.24 41.3 Favored Pre-proline 0 C--N 1.349 0.554 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -63.82 141.95 80.53 Favored 'Trans proline' 0 CA--C 1.517 -0.344 0 C-N-CA 121.721 1.614 . . . . 0.0 113.398 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.26 -37.64 94.9 Favored Glycine 0 C--N 1.357 1.743 0 O-C-N 121.862 -0.524 . . . . 0.0 112.449 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.47 -29.75 66.39 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 118.535 1.168 . . . . 0.0 109.887 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -36.45 64.96 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -69.71 -26.1 64.18 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.022 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.39 -48.54 80.76 Favored 'General case' 0 C--N 1.356 0.858 0 CA-C-O 122.133 0.968 . . . . 0.0 109.39 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.511 ' HD3' ' HH ' ' A' ' 96' ' ' TYR . 98.6 mtt180 -67.36 -42.18 83.9 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.287 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.5 -40.98 80.68 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.91 -0.494 . . . . 0.0 111.065 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 60.4 tp -67.08 -40.42 87.01 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 95.69 41.02 3.98 Favored Glycine 0 C--N 1.361 1.933 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -100.53 115.51 30.3 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -86.9 95.88 10.04 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 12.0 t . . . . . 0 C--O 1.264 1.859 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.643 179.084 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 N--CA 1.504 2.234 0 CA-C-O 121.459 0.647 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -141.93 161.87 36.9 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 121.334 -0.854 . . . . 0.0 108.969 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.3 pt -64.37 -21.29 28.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 123.546 0.738 . . . . 0.0 112.719 -178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -76.08 -8.6 57.37 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 121.131 -0.981 . . . . 0.0 111.165 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.39 -4.0 49.22 Favored 'General case' 0 C--N 1.357 0.915 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.6 mt -105.96 -112.93 0.26 Allowed 'General case' 0 C--N 1.349 0.553 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -90.01 158.3 44.57 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -54.92 128.87 32.36 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 120.813 1.009 . . . . 0.0 112.288 176.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.93 117.59 16.94 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 123.161 1.457 . . . . 0.0 112.245 -175.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -85.68 161.45 50.71 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 113.409 -1.723 . . . . 0.0 106.986 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.7 -24.57 63.77 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.49 2.127 . . . . 0.0 113.432 177.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -74.07 -52.76 11.65 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.581 1.153 . . . . 0.0 107.961 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.61 -46.23 81.02 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.287 1.435 . . . . 0.0 110.764 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.6 t -61.0 -42.71 94.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -71.26 -36.01 71.59 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.303 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.78 -40.82 75.82 Favored 'General case' 0 C--N 1.369 1.433 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -75.33 -19.4 59.64 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.914 -0.491 . . . . 0.0 112.127 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.4 m -60.55 -54.99 49.38 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -177.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -76.08 151.94 35.32 Favored 'Trans proline' 0 CA--C 1.512 -0.59 0 CA-C-N 121.576 1.599 . . . . 0.0 114.224 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -125.85 148.4 49.17 Favored 'General case' 0 C--N 1.353 0.748 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -87.39 62.93 7.45 Favored 'General case' 0 C--N 1.356 0.877 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 32.3 t -162.46 154.92 19.24 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -69.0 -37.15 78.55 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -150.3 152.34 34.33 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 75.01 175.74 0.24 Allowed 'General case' 0 C--N 1.37 1.464 0 CA-C-O 122.004 0.907 . . . . 0.0 110.106 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 76.5 mtm180 -88.1 146.74 25.28 Favored 'General case' 0 C--N 1.354 0.781 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.425 ' HG3' ' H ' ' A' ' 29' ' ' TYR . 31.7 tpt180 -95.65 145.63 25.11 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -58.92 -23.16 60.94 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.425 ' H ' ' HG3' ' A' ' 27' ' ' ARG . 24.8 m-85 -78.77 -13.79 59.62 Favored 'General case' 0 C--N 1.359 1.001 0 O-C-N 120.672 -1.267 . . . . 0.0 110.812 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -66.39 -55.03 21.2 Favored Pre-proline 0 C--N 1.367 1.351 0 O-C-N 121.283 -0.885 . . . . 0.0 112.345 -178.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -64.95 -20.25 64.14 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 120.804 1.323 . . . . 0.0 114.713 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -73.19 -29.47 62.85 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.43 -17.93 57.67 Favored 'General case' 0 C--N 1.365 1.259 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.29 -36.09 80.82 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.3 t -63.69 -38.08 89.76 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.67 -45.23 72.26 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -57.93 -37.71 74.6 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 124.65 1.18 . . . . 0.0 112.583 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.69 -10.23 25.59 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 121.305 -0.872 . . . . 0.0 112.529 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 125.39 2.49 7.56 Favored Glycine 0 C--N 1.374 2.663 0 CA-C-N 119.466 1.03 . . . . 0.0 111.889 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.0 t -68.24 -46.0 71.7 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-N 119.259 1.529 . . . . 0.0 109.828 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.31 -178.34 0.15 Allowed 'General case' 0 C--N 1.371 1.517 0 CA-C-O 121.301 0.572 . . . . 0.0 110.75 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.7 mp -140.6 125.92 19.6 Favored 'Isoleucine or valine' 0 C--N 1.363 1.191 0 CA-C-O 122.511 1.148 . . . . 0.0 108.453 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -154.03 125.71 7.63 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.41 -170.24 42.21 Favored Glycine 0 CA--C 1.492 -1.374 0 N-CA-C 108.456 -1.858 . . . . 0.0 108.456 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -119.13 112.66 19.8 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.3 tpt180 -95.66 132.49 40.79 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.04 129.8 37.4 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.959 1.362 . . . . 0.0 110.32 -178.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.1 t -114.0 119.34 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 104.177 -2.527 . . . . 0.0 104.177 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -72.61 135.95 45.62 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.419 0.628 . . . . 0.0 109.333 -178.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.41 -5.3 57.19 Favored Glycine 0 C--N 1.36 1.879 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.77 -103.5 0.38 Allowed Glycine 0 C--N 1.355 1.616 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.56 162.24 19.24 Favored Pre-proline 0 N--CA 1.447 -0.576 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -72.62 127.18 12.15 Favored 'Trans proline' 0 CA--C 1.514 -0.481 0 C-N-CA 121.161 1.24 . . . . 0.0 113.527 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 pt -110.19 137.75 41.1 Favored 'Isoleucine or valine' 0 C--N 1.358 0.963 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.9 m -64.34 140.57 58.88 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.133 0.968 . . . . 0.0 112.002 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -140.71 143.59 35.11 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -129.75 131.43 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.05 130.25 28.89 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 176.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.8 p -127.74 154.84 44.89 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-O 122.383 1.087 . . . . 0.0 109.55 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.02 132.13 46.11 Favored 'General case' 0 C--N 1.355 0.833 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.9 m -155.13 148.57 25.11 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 103.396 -2.816 . . . . 0.0 103.396 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.8 m -71.26 100.01 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 122.754 1.264 . . . . 0.0 110.134 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.1 p -100.63 163.75 17.52 Favored Pre-proline 0 C--N 1.356 0.877 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -53.29 154.66 13.97 Favored 'Trans proline' 0 C--O 1.208 -1.015 0 C-N-CA 122.037 1.825 . . . . 0.0 115.286 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.405 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 54.8 tp -50.03 -50.62 67.93 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -177.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.405 ' HD3' ' HB3' ' A' ' 65' ' ' LEU . 8.2 Cg_exo -73.04 -8.35 22.05 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.193 1.462 . . . . 0.0 112.339 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.22 24.38 11.2 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.249 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.23 70.41 2.86 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-O 122.241 1.02 . . . . 0.0 108.26 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.6 mtt -120.35 154.35 35.19 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 122.006 0.908 . . . . 0.0 110.068 -177.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 58.8 m -95.33 133.96 38.66 Favored 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.038 -2.208 . . . . 0.0 105.038 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -112.4 130.81 55.84 Favored 'General case' 0 C--N 1.359 1.016 0 CA-C-N 122.251 2.296 . . . . 0.0 109.318 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.3 t -126.08 135.82 52.18 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -115.4 124.3 50.85 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mt -126.01 125.32 42.47 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -101.78 137.59 39.89 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -86.11 113.81 22.47 Favored 'General case' 0 C--N 1.348 0.518 0 O-C-N 121.344 -0.847 . . . . 0.0 109.127 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 41.3 t30 63.89 26.29 14.22 Favored 'General case' 0 C--N 1.372 1.573 0 C-N-CA 123.475 0.71 . . . . 0.0 110.303 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 64.28 25.07 13.47 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 123.397 0.679 . . . . 0.0 111.003 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -94.8 122.52 37.51 Favored 'General case' 0 C--N 1.355 0.816 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.6 -35.65 78.46 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -70.47 -17.35 62.98 Favored 'General case' 0 C--N 1.358 0.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.523 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.9 mt -111.99 84.09 1.9 Allowed 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -122.65 131.73 53.94 Favored 'General case' 0 C--N 1.362 1.139 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -108.75 130.74 55.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -119.43 107.83 13.81 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -121.58 119.4 58.82 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.22 140.75 45.52 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -151.66 160.44 31.7 Favored Pre-proline 0 C--O 1.24 0.589 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.41 149.46 23.23 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 122.323 2.015 . . . . 0.0 111.709 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -61.84 -19.91 63.1 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 120.562 -1.336 . . . . 0.0 113.839 -174.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 49.9 p-80 -89.18 -24.52 22.14 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.34 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.01 -29.08 15.41 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.975 -0.453 . . . . 0.0 111.181 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -63.42 -38.09 89.79 Favored 'General case' 0 C--N 1.36 1.039 0 O-C-N 121.838 -0.538 . . . . 0.0 111.566 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.2 mp -66.28 -32.58 74.07 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.652 -1.28 . . . . 0.0 109.622 -179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -59.21 -42.45 91.0 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 120.225 1.375 . . . . 0.0 108.974 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -63.04 -48.68 77.7 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.916 0.886 . . . . 0.0 109.994 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.26 -43.14 99.37 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.84 -44.54 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 O-C-N 121.244 -0.91 . . . . 0.0 109.753 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.75 -40.14 96.31 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.54 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttm -62.49 -50.74 70.22 Favored 'General case' 0 C--N 1.358 0.944 0 C-N-CA 122.366 0.266 . . . . 0.0 110.586 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.57 -44.17 96.98 Favored 'General case' 0 C--N 1.362 1.111 0 CA-C-O 121.546 0.689 . . . . 0.0 109.923 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 60.1 ttm -62.24 -49.02 77.41 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.479 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.41 -49.45 73.93 Favored Glycine 0 C--N 1.359 1.837 0 CA-C-O 118.952 -0.916 . . . . 0.0 115.285 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -85.89 -33.13 21.32 Favored 'General case' 0 C--N 1.363 1.19 0 CA-C-N 120.175 1.987 . . . . 0.0 113.107 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -80.85 -50.22 10.08 Favored 'General case' 0 C--N 1.354 0.786 0 O-C-N 120.449 -1.407 . . . . 0.0 111.392 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -63.82 -43.9 94.85 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -177.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.0 mtp -88.41 -17.17 31.04 Favored 'General case' 0 C--N 1.363 1.167 0 O-C-N 121.164 -0.96 . . . . 0.0 110.783 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 62.18 42.58 9.42 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-O 122.459 1.123 . . . . 0.0 110.74 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.17 144.34 45.79 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.3 -1.318 . . . . 0.0 107.895 179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 24.1 p -89.09 -14.21 36.81 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 121.112 0.482 . . . . 0.0 109.708 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -98.85 127.14 44.7 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -85.02 162.36 49.72 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -59.15 148.1 87.41 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 121.568 1.512 . . . . 0.0 113.05 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -37.45 92.13 Favored Glycine 0 C--N 1.359 1.833 0 O-C-N 121.735 -0.603 . . . . 0.0 112.869 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.45 -26.38 63.62 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 118.798 1.299 . . . . 0.0 109.955 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -75.51 -30.78 59.92 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -73.07 -17.21 61.44 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 121.42 -0.8 . . . . 0.0 110.541 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -67.61 -42.58 82.18 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-O 122.761 1.267 . . . . 0.0 107.634 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -64.03 -41.09 97.53 Favored 'General case' 0 C--N 1.357 0.903 0 CA-C-N 113.188 -1.824 . . . . 0.0 110.814 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.4 mp -71.25 -40.02 71.26 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 122.086 -0.383 . . . . 0.0 110.294 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.8 tp -67.9 -39.72 83.56 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 122.729 0.412 . . . . 0.0 109.951 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 103.24 30.97 5.17 Favored Glycine 0 C--N 1.361 1.955 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -103.41 114.97 29.66 Favored 'General case' 0 C--N 1.355 0.806 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -91.89 97.29 10.88 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.268 2.067 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.71 179.331 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ttt . . . . . 0 N--CA 1.505 2.304 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -119.32 145.05 46.49 Favored 'General case' 0 C--N 1.361 1.095 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.9 pt -59.35 -19.71 16.79 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -79.39 -2.98 44.24 Favored 'General case' 0 C--N 1.365 1.264 0 CA-C-N 120.208 1.367 . . . . 0.0 110.571 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.27 -5.29 44.01 Favored 'General case' 0 C--N 1.357 0.916 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -107.1 -112.26 0.29 Allowed 'General case' 0 C--N 1.353 0.751 0 CA-C-O 121.98 0.895 . . . . 0.0 108.778 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -90.0 158.3 44.59 Favored Pre-proline 0 C--N 1.345 0.389 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -55.12 128.21 29.58 Favored 'Trans proline' 0 N--CA 1.478 0.577 0 CA-C-N 119.842 0.979 . . . . 0.0 112.257 176.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.06 117.79 18.98 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 123.119 1.437 . . . . 0.0 112.326 -175.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -85.64 160.78 52.65 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 113.487 -1.688 . . . . 0.0 106.933 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.5 -25.28 65.84 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.441 2.094 . . . . 0.0 113.513 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -74.86 -50.95 15.23 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -46.06 80.09 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 125.201 1.401 . . . . 0.0 110.586 177.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.1 t -61.24 -43.52 96.63 Favored 'Isoleucine or valine' 0 C--N 1.348 0.539 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.866 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.7 m -73.01 -34.49 66.41 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.79 -176.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -71.98 -41.04 68.15 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 121.36 -0.838 . . . . 0.0 110.26 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -70.44 -34.71 72.78 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.2 m -49.65 -51.61 58.09 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -176.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -81.93 125.61 4.83 Favored 'Trans proline' 0 CA--C 1.516 -0.407 0 CA-C-N 121.788 1.674 . . . . 0.0 113.196 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -150.19 160.69 43.49 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.662 -1.607 . . . . 0.0 106.662 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -96.02 146.11 24.9 Favored 'General case' 0 C--N 1.35 0.616 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.6 m -161.52 71.38 0.38 Allowed 'General case' 0 C--N 1.353 0.753 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -70.61 -40.38 73.23 Favored 'General case' 0 C--N 1.361 1.081 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -160.56 145.72 14.58 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 60.52 -121.76 0.93 Allowed 'General case' 0 C--N 1.366 1.307 0 C-N-CA 122.853 0.461 . . . . 0.0 110.023 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 91.0 mmt-85 -136.41 146.36 46.33 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -96.32 126.03 41.24 Favored 'General case' 0 C--N 1.357 0.921 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -65.67 -18.56 65.42 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.906 -179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -66.56 -38.63 87.51 Favored 'General case' 0 C--N 1.348 0.535 0 O-C-N 121.906 -0.496 . . . . 0.0 111.83 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.73 -56.66 27.29 Favored Pre-proline 0 C--N 1.364 1.207 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.71 -19.31 36.55 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 120.94 1.371 . . . . 0.0 114.667 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -70.59 -37.84 73.95 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.31 -27.48 60.73 Favored 'General case' 0 C--N 1.366 1.285 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.03 -38.18 85.46 Favored 'General case' 0 C--N 1.365 1.26 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.6 m -65.4 -39.81 92.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.125 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 72.4 mt -69.07 -39.46 79.08 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 121.486 -0.759 . . . . 0.0 110.136 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -53.76 -27.05 26.41 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 125.355 1.462 . . . . 0.0 112.823 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -64.34 -11.97 37.61 Favored 'General case' 0 C--N 1.363 1.192 0 O-C-N 121.133 -0.979 . . . . 0.0 112.505 -178.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.78 -0.33 10.98 Favored Glycine 0 C--N 1.371 2.499 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.6 m -69.7 -41.65 75.13 Favored 'General case' 0 C--N 1.358 0.936 0 CA-C-N 118.241 1.021 . . . . 0.0 109.647 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 66.18 -178.89 0.2 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.558 0.695 . . . . 0.0 110.852 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.6 mp -135.79 124.88 39.7 Favored 'Isoleucine or valine' 0 C--N 1.358 0.975 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -150.06 126.65 10.91 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 103.193 -2.892 . . . . 0.0 103.193 178.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 179.17 -171.02 42.93 Favored Glycine 0 CA--C 1.492 -1.371 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -121.3 115.32 22.76 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 tpt180 -91.91 130.31 37.7 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.82 116.38 20.78 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.829 1.299 . . . . 0.0 110.478 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 91.5 t -96.91 109.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 N-CA-C 104.426 -2.435 . . . . 0.0 104.426 176.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -70.49 131.08 43.49 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.78 58.35 Favored Glycine 0 C--N 1.359 1.814 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -134.77 -107.88 0.96 Allowed Glycine 0 C--N 1.356 1.654 0 N-CA-C 108.604 -1.799 . . . . 0.0 108.604 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.57 158.38 25.04 Favored Pre-proline 0 N--CA 1.445 -0.699 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -178.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.58 121.62 6.46 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.179 1.253 . . . . 0.0 112.963 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 3.6 pt -108.31 136.05 45.12 Favored 'Isoleucine or valine' 0 C--N 1.358 0.978 0 CA-C-O 122.217 1.008 . . . . 0.0 108.709 -178.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.0 m -65.28 141.45 58.6 Favored 'General case' 0 C--N 1.364 1.196 0 CA-C-O 122.186 0.993 . . . . 0.0 112.099 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -141.19 145.29 35.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -129.71 130.61 66.84 Favored 'Isoleucine or valine' 0 C--N 1.351 0.664 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.56 136.06 35.65 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.2 t -135.09 152.62 51.83 Favored 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.324 1.059 . . . . 0.0 109.562 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -123.72 114.76 20.37 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 66.4 p -140.3 161.15 38.36 Favored 'General case' 0 CA--C 1.497 -1.093 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -79.6 101.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 CA-C-O 122.377 1.084 . . . . 0.0 109.835 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -99.45 161.77 23.47 Favored Pre-proline 0 C--N 1.355 0.821 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_exo -53.64 156.47 11.57 Favored 'Trans proline' 0 C--O 1.207 -1.067 0 C-N-CA 122.145 1.896 . . . . 0.0 115.772 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.8 tp -49.24 -53.54 38.38 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -73.73 -6.42 18.62 Favored 'Trans proline' 0 C--N 1.353 0.799 0 CA-C-N 121.226 1.474 . . . . 0.0 112.636 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -116.97 25.15 10.71 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.71 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 68.96 2.4 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-O 122.195 0.997 . . . . 0.0 108.555 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 59.1 mtt -125.46 152.82 44.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.925 -177.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -90.82 134.05 34.74 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -110.55 131.09 55.35 Favored 'General case' 0 C--N 1.36 1.031 0 CA-C-N 122.063 2.211 . . . . 0.0 109.726 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.1 t -124.96 136.66 53.95 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.6 123.86 49.5 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.0 131.59 52.19 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -178.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -101.71 140.42 36.02 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.119 -1.438 . . . . 0.0 107.119 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -85.86 110.7 19.58 Favored 'General case' 0 C--N 1.348 0.52 0 O-C-N 121.356 -0.84 . . . . 0.0 109.077 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.41 26.43 15.76 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 123.702 0.801 . . . . 0.0 110.595 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 67.41 21.77 9.59 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 123.604 0.762 . . . . 0.0 110.959 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -91.28 114.94 27.61 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.49 -24.71 67.62 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -74.6 -15.85 60.82 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.372 -0.83 . . . . 0.0 109.337 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.2 mt -116.04 87.49 2.69 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.4 m -120.94 130.65 53.94 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -109.11 133.15 53.38 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.64 108.76 15.33 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 103.388 -2.819 . . . . 0.0 103.388 177.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 118.67 57.41 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 -176.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.99 141.79 46.31 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -151.04 159.06 34.34 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -52.26 149.62 21.91 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 C-N-CA 122.398 2.066 . . . . 0.0 111.973 176.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.22 -19.38 54.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.784 -1.198 . . . . 0.0 113.538 -174.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -89.8 -23.74 21.65 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.306 -0.871 . . . . 0.0 109.787 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -94.39 -30.45 14.48 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 123.054 0.541 . . . . 0.0 111.357 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.82 -39.27 93.78 Favored 'General case' 0 C--N 1.361 1.1 0 O-C-N 121.901 -0.499 . . . . 0.0 112.204 -176.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.92 -32.92 74.87 Favored 'General case' 0 C--O 1.205 -1.245 0 O-C-N 120.617 -1.302 . . . . 0.0 110.12 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.21 -41.69 89.17 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 119.952 1.251 . . . . 0.0 109.26 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -62.29 -48.21 80.88 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.81 0.844 . . . . 0.0 109.765 175.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.6 -42.57 99.06 Favored 'General case' 0 C--N 1.359 1.011 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.89 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -64.14 -43.22 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 O-C-N 121.337 -0.852 . . . . 0.0 109.519 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.03 -40.3 95.27 Favored 'General case' 0 C--N 1.363 1.163 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 45.5 ttm -62.85 -49.34 75.27 Favored 'General case' 0 C--N 1.356 0.89 0 CA-C-O 120.884 0.374 . . . . 0.0 111.01 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.23 -45.96 82.56 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 121.457 0.646 . . . . 0.0 109.978 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.4 ttm -62.65 -49.83 73.59 Favored 'General case' 0 C--O 1.217 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.553 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.67 -45.17 96.35 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 121.333 -0.855 . . . . 0.0 113.962 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -86.82 -37.8 17.44 Favored 'General case' 0 C--N 1.358 0.947 0 CA-C-N 119.436 1.618 . . . . 0.0 113.008 -176.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -81.37 -50.7 9.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 120.507 -1.37 . . . . 0.0 111.877 -176.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -64.87 -42.58 94.72 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.4 mtp -84.01 -22.44 31.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.886 -1.134 . . . . 0.0 110.803 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 59.91 37.81 21.4 Favored 'General case' 0 C--N 1.369 1.425 0 CA-C-O 122.255 1.026 . . . . 0.0 110.921 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -127.83 145.88 50.79 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.591 -1.186 . . . . 0.0 108.405 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.1 t -89.06 -4.35 58.39 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.62 107.92 16.38 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -85.39 151.75 56.77 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.19 140.16 76.26 Favored 'Trans proline' 0 N--CA 1.472 0.256 0 C-N-CA 121.544 1.496 . . . . 0.0 113.37 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -37.08 93.54 Favored Glycine 0 C--N 1.357 1.725 0 O-C-N 121.88 -0.513 . . . . 0.0 112.417 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.73 -29.55 65.84 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.508 1.154 . . . . 0.0 109.69 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -72.78 -37.75 67.51 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -71.35 -24.75 62.16 Favored 'General case' 0 C--N 1.367 1.344 0 O-C-N 121.818 -0.551 . . . . 0.0 110.401 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.23 -46.5 90.17 Favored 'General case' 0 C--N 1.359 0.979 0 CA-C-O 121.953 0.882 . . . . 0.0 109.501 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -65.59 -39.58 91.73 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.748 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -43.67 77.64 Favored 'General case' 0 C--N 1.363 1.183 0 O-C-N 121.799 -0.563 . . . . 0.0 110.575 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.88 -41.25 83.08 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 122.766 0.426 . . . . 0.0 110.094 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 90.72 42.19 5.16 Favored Glycine 0 C--N 1.361 1.929 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -102.16 115.11 29.86 Favored 'General case' 0 C--N 1.352 0.698 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -89.58 96.39 10.68 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 24.2 t . . . . . 0 C--O 1.267 2.004 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.293 178.391 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.7 tpt . . . . . 0 N--CA 1.503 2.181 0 CA-C-O 121.713 0.768 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -109.12 137.02 47.66 Favored 'General case' 0 C--N 1.359 1.005 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.2 tt -57.15 -24.68 21.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.352 0 C-N-CA 123.864 0.866 . . . . 0.0 112.648 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.29 -15.14 63.45 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 121.67 -0.643 . . . . 0.0 110.739 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -89.4 -5.68 57.23 Favored 'General case' 0 C--N 1.361 1.083 0 O-C-N 121.623 -0.673 . . . . 0.0 109.555 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -101.67 -104.14 0.26 Allowed 'General case' 0 C--N 1.35 0.609 0 CA-C-O 122.089 0.947 . . . . 0.0 109.108 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.3 p -89.93 153.99 47.44 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -56.78 126.56 22.64 Favored 'Trans proline' 0 C--N 1.349 0.584 0 CA-C-N 119.635 0.905 . . . . 0.0 111.259 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.26 119.05 24.09 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.399 1.571 . . . . 0.0 112.563 -175.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -84.1 164.79 42.26 Favored Pre-proline 0 N--CA 1.439 -0.99 0 CA-C-N 112.954 -1.93 . . . . 0.0 106.036 175.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -55.52 -26.94 57.01 Favored 'Trans proline' 0 N--CA 1.486 1.066 0 C-N-CA 122.133 1.888 . . . . 0.0 113.031 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.65 -51.07 25.02 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 124.498 1.119 . . . . 0.0 108.954 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.36 81.58 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.031 1.332 . . . . 0.0 111.04 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 45.6 t -61.26 -44.03 97.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.049 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 67.5 m -72.42 -36.66 68.64 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.919 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.57 -41.04 69.53 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 121.522 -0.736 . . . . 0.0 110.68 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -66.23 -36.07 82.08 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.0 m -52.58 -54.76 39.18 Favored Pre-proline 0 N--CA 1.487 1.424 0 N-CA-C 114.714 1.375 . . . . 0.0 114.714 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -76.98 157.86 34.45 Favored 'Trans proline' 0 CA--C 1.516 -0.419 0 CA-C-N 121.486 1.567 . . . . 0.0 114.542 179.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -153.27 160.7 42.8 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -147.32 138.01 23.51 Favored 'General case' 0 C--N 1.352 0.68 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.8 t -157.98 151.79 23.9 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -101.34 12.38 37.54 Favored 'General case' 0 C--N 1.356 0.878 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.96 167.22 22.71 Favored 'General case' 0 C--N 1.352 0.679 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -81.93 58.15 3.77 Favored 'General case' 0 C--N 1.359 1.016 0 O-C-N 121.489 -0.757 . . . . 0.0 110.082 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -159.54 131.85 6.55 Favored 'General case' 0 C--N 1.35 0.604 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -86.45 64.81 8.74 Favored 'General case' 0 C--N 1.357 0.893 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.5 tpt180 -64.72 -43.98 91.66 Favored 'General case' 0 C--N 1.356 0.863 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -74.73 -22.07 59.01 Favored 'General case' 0 C--N 1.359 1.002 0 O-C-N 121.208 -0.932 . . . . 0.0 113.216 -177.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.43 -56.11 38.53 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.13 -18.12 24.05 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 CA-C-N 121.201 1.465 . . . . 0.0 114.508 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -70.17 -37.26 75.12 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.32 -24.22 57.38 Favored 'General case' 0 C--N 1.359 1.015 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.69 -178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.0 mt -66.83 -38.58 86.7 Favored 'General case' 0 C--N 1.363 1.172 0 O-C-N 121.558 -0.714 . . . . 0.0 109.846 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.0 t -65.77 -41.12 92.43 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 80.2 mt -64.59 -39.95 94.65 Favored 'General case' 0 C--N 1.36 1.054 0 O-C-N 121.499 -0.751 . . . . 0.0 109.446 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.62 -21.04 15.83 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.146 1.378 . . . . 0.0 112.647 178.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -70.13 -17.55 63.2 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.262 -0.899 . . . . 0.0 111.014 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.97 5.2 7.59 Favored Glycine 0 C--N 1.359 1.827 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.9 t -69.29 -44.09 72.51 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.272 1.036 . . . . 0.0 109.099 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 67.79 178.27 0.24 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.591 0.71 . . . . 0.0 110.54 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 2.6 mp -135.08 123.11 39.18 Favored 'Isoleucine or valine' 0 C--N 1.358 0.954 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -150.42 126.67 10.66 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 103.272 -2.862 . . . . 0.0 103.272 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.65 -168.91 40.2 Favored Glycine 0 CA--C 1.493 -1.335 0 N-CA-C 108.292 -1.923 . . . . 0.0 108.292 -178.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.6 p -121.45 114.51 21.37 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.52 134.27 35.13 Favored 'General case' 0 C--N 1.355 0.839 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 118.62 24.12 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.746 1.26 . . . . 0.0 110.326 -176.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.2 t -98.9 108.67 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 104.281 -2.489 . . . . 0.0 104.281 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -68.9 129.75 40.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 101.74 -8.59 56.42 Favored Glycine 0 C--N 1.361 1.918 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -133.91 -107.45 0.98 Allowed Glycine 0 C--N 1.355 1.601 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.59 158.6 25.28 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 124.38 8.3 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.178 1.252 . . . . 0.0 113.035 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.8 pt -111.12 139.72 33.75 Favored 'Isoleucine or valine' 0 C--N 1.356 0.866 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.4 p -65.9 144.9 56.51 Favored 'General case' 0 C--N 1.365 1.281 0 CA-C-O 121.746 0.784 . . . . 0.0 111.974 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -142.65 143.62 32.43 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.5 t -129.56 129.61 66.81 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.09 133.87 32.15 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -132.26 151.58 51.76 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 122.445 1.117 . . . . 0.0 108.754 -178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -119.29 124.26 46.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 105.58 -2.008 . . . . 0.0 105.58 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.6 m -155.91 144.64 20.34 Favored 'General case' 0 CA--C 1.493 -1.212 0 N-CA-C 103.933 -2.618 . . . . 0.0 103.933 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -69.57 100.97 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-O 122.432 1.111 . . . . 0.0 110.86 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.76 156.95 34.58 Favored Pre-proline 0 C--N 1.352 0.674 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.69 152.33 1.67 Allowed 'Trans proline' 0 C--O 1.204 -1.216 0 C-N-CA 122.907 2.405 . . . . 0.0 117.029 -177.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.33 -50.9 73.49 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -176.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.07 -5.02 16.27 Favored 'Trans proline' 0 CA--C 1.511 -0.65 0 CA-C-N 121.036 1.406 . . . . 0.0 112.123 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.81 24.65 10.91 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -70.48 68.87 0.38 Allowed 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.557 0.694 . . . . 0.0 110.323 -178.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.1 mtt -124.39 153.93 41.15 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.826 0.822 . . . . 0.0 109.607 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.7 m -94.33 135.61 35.54 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 mtt85 -115.64 129.61 56.56 Favored 'General case' 0 C--N 1.361 1.079 0 CA-C-N 122.167 2.258 . . . . 0.0 109.64 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.4 t -123.33 141.23 52.2 Favored 'General case' 0 C--N 1.353 0.725 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -120.12 124.18 45.17 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -126.33 133.65 51.31 Favored 'General case' 0 C--N 1.355 0.838 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -103.88 139.56 38.89 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -86.24 112.52 21.45 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.662 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.66 25.31 15.05 Favored 'General case' 0 C--N 1.374 1.645 0 C-N-CA 123.717 0.807 . . . . 0.0 110.369 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 66.17 23.82 10.89 Favored 'General case' 0 C--N 1.371 1.509 0 C-N-CA 123.578 0.751 . . . . 0.0 110.693 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -93.44 118.17 30.99 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -18.3 65.23 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -85.59 -4.53 59.19 Favored 'General case' 0 C--N 1.357 0.934 0 O-C-N 121.211 -0.931 . . . . 0.0 109.58 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.06 95.33 4.27 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.3 p -126.05 149.6 48.75 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-O 122.115 0.959 . . . . 0.0 109.353 -176.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -126.42 132.24 51.55 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -120.82 108.29 13.76 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 103.194 -2.891 . . . . 0.0 103.194 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mm -120.51 118.93 58.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.097 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.32 142.21 45.77 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.12 159.75 33.12 Favored Pre-proline 0 C--O 1.239 0.541 0 N-CA-C 105.631 -1.988 . . . . 0.0 105.631 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -52.19 149.26 22.41 Favored 'Trans proline' 0 N--CA 1.484 0.953 0 C-N-CA 122.343 2.028 . . . . 0.0 111.502 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.21 -18.67 59.44 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.633 -1.292 . . . . 0.0 113.727 -174.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -89.7 -22.9 22.0 Favored 'General case' 0 C--N 1.355 0.822 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -94.61 -29.67 14.74 Favored 'General case' 0 C--N 1.357 0.933 0 O-C-N 121.784 -0.573 . . . . 0.0 111.134 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -64.61 -40.79 96.13 Favored 'General case' 0 C--N 1.361 1.082 0 O-C-N 121.944 -0.473 . . . . 0.0 111.857 -176.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.76 -32.83 74.6 Favored 'General case' 0 C--O 1.207 -1.183 0 O-C-N 120.461 -1.4 . . . . 0.0 110.101 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -59.52 -41.31 89.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.136 1.334 . . . . 0.0 108.893 177.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -63.2 -48.18 79.44 Favored 'General case' 0 C--N 1.351 0.671 0 C-N-CA 123.622 0.769 . . . . 0.0 110.011 175.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -42.48 96.37 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.607 0.363 . . . . 0.0 111.595 -176.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.88 -44.7 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 121.485 -0.759 . . . . 0.0 109.62 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.63 -40.86 96.35 Favored 'General case' 0 C--N 1.363 1.193 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -63.03 -49.21 75.49 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.718 0.407 . . . . 0.0 110.913 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.01 -46.41 78.05 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-O 121.631 0.729 . . . . 0.0 110.247 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttm -62.45 -49.92 73.52 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.942 -178.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.2 -44.29 97.92 Favored Glycine 0 C--N 1.358 1.79 0 CA-C-O 119.371 -0.683 . . . . 0.0 114.11 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -85.49 -38.13 18.92 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.387 1.594 . . . . 0.0 112.34 -176.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -78.39 -50.09 12.36 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 120.647 -1.283 . . . . 0.0 111.975 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -66.24 -42.34 88.75 Favored 'General case' 0 C--N 1.357 0.896 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 86.8 mtp -86.33 -22.55 26.64 Favored 'General case' 0 C--N 1.367 1.337 0 O-C-N 120.743 -1.223 . . . . 0.0 110.703 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 62.61 32.51 16.31 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-O 122.067 0.937 . . . . 0.0 111.148 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -114.41 141.74 47.27 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.3 t -86.7 -9.05 56.81 Favored 'General case' 0 C--N 1.362 1.144 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -88.41 121.99 31.42 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -87.76 153.31 52.42 Favored Pre-proline 0 C--N 1.348 0.537 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -63.17 142.1 85.46 Favored 'Trans proline' 0 CA--C 1.519 -0.249 0 C-N-CA 121.611 1.541 . . . . 0.0 113.18 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.89 -38.28 95.74 Favored Glycine 0 C--N 1.357 1.701 0 O-C-N 121.82 -0.55 . . . . 0.0 112.585 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.65 -28.6 63.87 Favored 'General case' 0 C--N 1.36 1.043 0 CA-C-N 118.723 1.262 . . . . 0.0 109.652 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -72.65 -34.11 67.04 Favored 'General case' 0 C--N 1.356 0.881 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -73.56 -24.24 60.07 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 121.194 -0.941 . . . . 0.0 110.378 -179.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -61.98 -49.94 74.08 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-O 121.378 0.608 . . . . 0.0 111.314 -178.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.05 -23.96 63.18 Favored 'General case' 0 C--N 1.363 1.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.065 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.2 mp -84.04 -42.19 16.42 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.571 -0.706 . . . . 0.0 109.33 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.0 tp -68.21 -40.45 82.14 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 88.25 21.44 45.19 Favored Glycine 0 C--N 1.366 2.226 0 N-CA-C 110.236 -1.146 . . . . 0.0 110.236 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -97.08 115.85 28.23 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -84.98 96.47 9.39 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 79.2 p . . . . . 0 C--O 1.264 1.841 0 CA-C-O 117.357 -1.306 . . . . 0.0 111.045 179.905 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 . . . . . 0 CA--C 1.515 -0.386 0 CA-C-O 121.992 0.901 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.76 -19.41 25.36 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.796 -178.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -72.95 -11.08 60.44 Favored 'General case' 0 C--N 1.362 1.143 0 O-C-N 121.139 -0.976 . . . . 0.0 110.671 -178.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -93.15 -6.41 47.95 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.5 mt -103.87 -114.58 0.23 Allowed 'General case' 0 C--N 1.353 0.722 0 CA-C-O 121.942 0.877 . . . . 0.0 109.102 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.723 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -89.52 158.05 46.24 Favored Pre-proline 0 C--N 1.345 0.39 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.723 ' HD2' HG22 ' A' ' 7' ' ' VAL . 85.3 Cg_exo -54.82 129.0 32.81 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 120.795 0.996 . . . . 0.0 112.181 176.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.92 117.0 14.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-O 123.415 1.579 . . . . 0.0 112.631 -175.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -85.8 160.91 51.92 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -60.42 -23.6 75.33 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 121.467 1.445 . . . . 0.0 113.01 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -73.12 -47.87 40.52 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-O 122.392 1.091 . . . . 0.0 108.601 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.35 93.32 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 125.07 1.348 . . . . 0.0 110.778 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.8 t -61.56 -44.36 98.5 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.962 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.2 p -73.21 -33.42 65.36 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 119.076 -1.05 . . . . 0.0 111.671 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.44 -38.93 71.29 Favored 'General case' 0 C--N 1.361 1.07 0 O-C-N 121.272 -0.893 . . . . 0.0 110.285 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.465 ' CD1' HD21 ' A' ' 34' ' ' LEU . 71.3 t80 -79.54 -13.64 59.4 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 121.921 -0.487 . . . . 0.0 111.742 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 17.5 m -59.19 -51.81 79.02 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 120.636 -1.29 . . . . 0.0 114.121 -177.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo . . . . . 0 C--N 1.349 0.572 0 CA-C-N 121.551 1.59 . . . . 0.0 114.683 -179.753 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.9 tp -64.04 -54.68 38.19 Favored Pre-proline 0 C--N 1.361 1.104 0 O-C-N 121.326 -0.859 . . . . 0.0 112.82 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.97 -22.4 42.03 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.02 1.4 . . . . 0.0 114.506 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -70.86 -38.36 73.15 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.9 -33.49 68.37 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.465 HD21 ' CD1' ' A' ' 17' ' ' TYR . 80.1 mt -63.46 -39.47 94.55 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 121.644 -0.66 . . . . 0.0 109.529 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.7 m -64.07 -40.31 95.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.469 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.81 HD13 HD11 ' A' ' 42' ' ' ILE . 59.2 mt -69.04 -39.73 79.02 Favored 'General case' 0 C--N 1.361 1.077 0 CA-C-O 121.094 0.474 . . . . 0.0 110.016 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -51.78 -23.7 4.99 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 125.651 1.58 . . . . 0.0 113.408 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -66.91 -19.82 65.8 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.509 -0.744 . . . . 0.0 111.497 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 130.03 -0.69 5.74 Favored Glycine 0 C--N 1.359 1.844 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.3 m -66.64 -41.83 87.67 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 118.28 1.04 . . . . 0.0 109.515 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 m 65.72 177.91 0.21 Allowed 'General case' 0 C--N 1.375 1.678 0 CA-C-O 121.676 0.751 . . . . 0.0 110.848 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.81 HD11 HD13 ' A' ' 36' ' ' LEU . 3.0 mp -132.59 126.8 55.45 Favored 'Isoleucine or valine' 0 C--N 1.359 0.98 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -154.99 133.65 12.03 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.05 -170.22 43.33 Favored Glycine 0 CA--C 1.491 -1.425 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 50.3 m -120.69 114.45 21.69 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -91.53 129.07 37.57 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.21 123.15 27.68 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.915 1.341 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.563 HG13 ' HB3' ' A' ' 104' ' ' TYR . 92.7 t -107.2 116.47 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.24 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 177.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -72.33 136.69 46.27 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.589 0.709 . . . . 0.0 109.39 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.28 -8.1 62.4 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 110.277 -1.129 . . . . 0.0 110.277 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.8 -104.15 0.61 Allowed Glycine 0 C--N 1.354 1.561 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.14 159.16 21.37 Favored Pre-proline 0 N--CA 1.448 -0.562 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.7 124.01 7.88 Favored 'Trans proline' 0 CA--C 1.515 -0.466 0 C-N-CA 121.341 1.361 . . . . 0.0 112.818 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.52 136.15 45.07 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 CA-C-O 122.244 1.021 . . . . 0.0 108.927 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 57.8 m -65.02 141.47 58.75 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.165 0.983 . . . . 0.0 112.276 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -141.06 144.42 34.94 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 54.8 t -130.38 131.79 65.17 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.54 134.3 33.72 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.7 m -131.16 132.21 44.59 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 122.19 0.995 . . . . 0.0 109.099 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -113.97 132.15 56.07 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.8 t -164.17 179.19 7.05 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.91 99.93 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.297 0 CA-C-O 122.628 1.204 . . . . 0.0 109.383 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.8 t -100.59 144.53 28.67 Favored Pre-proline 0 C--N 1.354 0.779 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -49.37 149.71 8.98 Favored 'Trans proline' 0 CA--C 1.501 -1.136 0 C-N-CA 122.526 2.15 . . . . 0.0 116.334 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.0 tp -46.72 -51.06 40.12 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.27 -6.35 17.11 Favored 'Trans proline' 0 C--N 1.353 0.778 0 CA-C-N 121.44 1.55 . . . . 0.0 112.425 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.25 27.23 9.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.898 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -68.54 64.8 0.11 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-O 121.252 0.549 . . . . 0.0 110.582 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.2 mtt -125.02 152.87 43.68 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.784 0.802 . . . . 0.0 108.966 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.7 m -95.92 132.86 40.76 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -109.99 131.91 54.63 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 122.194 2.27 . . . . 0.0 109.824 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.5 t -125.08 137.45 54.2 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -115.18 125.33 53.28 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.3 129.33 47.49 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.09 138.87 39.35 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -86.02 112.3 21.1 Favored 'General case' 0 C--N 1.349 0.575 0 O-C-N 121.266 -0.896 . . . . 0.0 109.205 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.1 t30 63.83 26.69 14.41 Favored 'General case' 0 C--N 1.372 1.569 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.131 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 64.93 24.19 12.66 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 123.529 0.732 . . . . 0.0 110.895 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.63 116.15 28.75 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.59 -25.38 68.05 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -75.79 -14.15 60.3 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 121.195 -0.941 . . . . 0.0 109.613 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.9 mt -116.94 85.6 2.35 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.3 m -120.36 130.19 54.29 Favored 'General case' 0 C--N 1.361 1.106 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -109.17 132.3 54.24 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -118.5 107.88 14.32 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.8 mm -118.87 118.96 59.53 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.191 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.97 141.97 46.36 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -150.08 160.14 34.05 Favored Pre-proline 0 CA--C 1.51 -0.564 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.31 150.38 15.01 Favored 'Trans proline' 0 N--CA 1.485 0.979 0 C-N-CA 122.16 1.907 . . . . 0.0 111.716 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -62.7 -19.18 63.63 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 120.323 -1.486 . . . . 0.0 113.728 -174.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -89.1 -24.58 22.23 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.45 -29.34 16.31 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 123.124 0.57 . . . . 0.0 111.137 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.68 -39.82 94.32 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 122.035 -0.416 . . . . 0.0 111.905 -176.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -63.97 -37.53 87.74 Favored 'General case' 0 C--N 1.359 0.995 0 O-C-N 120.447 -1.408 . . . . 0.0 110.269 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -58.16 -41.36 83.63 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 120.271 1.396 . . . . 0.0 109.593 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -61.19 -48.3 82.18 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 109.952 175.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.92 -41.54 91.97 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.762 -176.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.72 -45.45 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 121.429 -0.794 . . . . 0.0 109.59 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.82 -40.8 98.49 Favored 'General case' 0 C--N 1.36 1.049 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.125 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -62.65 -47.65 82.79 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 122.635 0.374 . . . . 0.0 110.728 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.12 -44.94 82.85 Favored 'General case' 0 C--N 1.36 1.058 0 CA-C-O 121.446 0.641 . . . . 0.0 109.864 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.5 ttt -61.81 -48.73 79.3 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.482 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.14 -46.66 92.75 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 121.282 -0.886 . . . . 0.0 113.617 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.563 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.2 m-85 -88.15 -39.22 14.71 Favored 'General case' 0 C--N 1.36 1.053 0 CA-C-N 119.328 1.564 . . . . 0.0 113.793 -176.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -83.86 -53.38 5.64 Favored 'General case' 0 C--N 1.354 0.787 0 O-C-N 120.29 -1.507 . . . . 0.0 111.983 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -62.84 -40.78 98.49 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.3 mmt -85.41 -20.69 29.45 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 121.017 -1.052 . . . . 0.0 110.833 -176.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 60.03 53.78 4.46 Favored 'General case' 0 C--N 1.366 1.316 0 CA-C-O 122.387 1.089 . . . . 0.0 111.835 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.73 155.36 38.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.5 m -109.85 55.53 0.64 Allowed 'General case' 0 C--N 1.364 1.237 0 CA-C-O 122.127 0.965 . . . . 0.0 108.677 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -132.49 115.34 15.38 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.449 -1.685 . . . . 0.0 106.449 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -85.4 144.72 40.98 Favored Pre-proline 0 C--N 1.35 0.622 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -63.77 143.79 87.24 Favored 'Trans proline' 0 CA--C 1.518 -0.28 0 C-N-CA 121.48 1.453 . . . . 0.0 112.793 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.89 96.54 Favored Glycine 0 C--N 1.355 1.627 0 O-C-N 121.743 -0.598 . . . . 0.0 112.906 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -73.17 -28.32 62.15 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.903 1.351 . . . . 0.0 109.681 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -73.34 -36.53 66.18 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -70.6 -23.14 62.51 Favored 'General case' 0 C--N 1.365 1.279 0 O-C-N 121.909 -0.494 . . . . 0.0 110.369 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -61.83 -47.0 87.03 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-O 122.189 0.995 . . . . 0.0 109.345 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -66.31 -39.32 89.21 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.649 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.07 -43.4 78.66 Favored 'General case' 0 C--N 1.364 1.203 0 O-C-N 121.826 -0.546 . . . . 0.0 110.332 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.58 -40.87 89.16 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.362 1.976 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -179.998 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.433 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 57.1 ttp180 . . . . . 0 CA--C 1.519 -0.226 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.2 pt -61.73 -20.66 23.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.272 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.433 ' H ' ' HG2' ' A' ' 2' ' ' ARG . 98.4 m-20 -74.08 -9.91 59.09 Favored 'General case' 0 C--N 1.362 1.13 0 O-C-N 121.373 -0.829 . . . . 0.0 110.248 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -90.29 -6.9 54.61 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 80.7 mt -106.84 -108.67 0.31 Allowed 'General case' 0 C--N 1.352 0.701 0 CA-C-O 122.099 0.952 . . . . 0.0 109.253 -178.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.4 p -89.62 152.49 47.13 Favored Pre-proline 0 C--O 1.236 0.389 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -57.68 125.99 20.44 Favored 'Trans proline' 0 C--N 1.348 0.539 0 CA-C-N 119.737 0.942 . . . . 0.0 111.259 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.89 120.09 23.0 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 123.251 1.501 . . . . 0.0 112.761 -175.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -83.49 162.32 53.84 Favored Pre-proline 0 N--CA 1.443 -0.787 0 CA-C-N 113.388 -1.733 . . . . 0.0 106.403 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -55.79 -24.59 47.49 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.488 2.125 . . . . 0.0 113.692 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.6 mtt180 -75.13 -52.25 11.43 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 124.513 1.125 . . . . 0.0 108.289 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.8 77.95 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.23 1.412 . . . . 0.0 110.802 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -60.96 -44.05 97.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.565 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.17 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.3 m -72.69 -37.46 67.84 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.79 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.71 -40.64 76.17 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 121.583 -0.698 . . . . 0.0 110.297 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -71.23 -20.44 62.25 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.1 m -58.95 -54.84 52.47 Favored Pre-proline 0 N--CA 1.486 1.349 0 O-C-N 120.976 -1.078 . . . . 0.0 113.422 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo . . . . . 0 C--N 1.348 0.514 0 CA-C-N 121.323 1.508 . . . . 0.0 113.958 178.367 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 . . . . . 0 CA--C 1.534 0.338 0 CA-C-O 119.822 -0.132 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.468 ' HB3' ' HD3' ' A' ' 31' ' ' PRO . 46.0 tp -64.96 -56.06 23.34 Favored Pre-proline 0 C--N 1.367 1.331 0 O-C-N 121.367 -0.833 . . . . 0.0 112.431 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 30' ' ' LEU . 37.7 Cg_exo -61.52 -23.08 76.05 Favored 'Trans proline' 0 C--N 1.358 1.047 0 CA-C-N 121.185 1.459 . . . . 0.0 115.09 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -68.16 -36.26 79.37 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.96 -19.13 60.24 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 121.955 -0.466 . . . . 0.0 109.952 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.8 mt -70.77 -20.12 62.64 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 121.378 -0.827 . . . . 0.0 109.821 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.6 m -84.68 -18.25 35.92 Favored 'General case' 0 C--N 1.351 0.657 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.717 HD13 HD11 ' A' ' 42' ' ' ILE . 70.0 mt -88.38 -43.79 11.24 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -55.61 -25.68 39.95 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 124.466 1.106 . . . . 0.0 113.07 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.21 -10.5 54.9 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 121.444 -0.785 . . . . 0.0 111.892 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.58 5.64 11.03 Favored Glycine 0 C--N 1.375 2.703 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 m -71.17 -43.03 68.29 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 118.259 1.029 . . . . 0.0 109.293 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.6 t 67.33 179.77 0.22 Allowed 'General case' 0 C--N 1.374 1.656 0 CA-C-O 121.592 0.71 . . . . 0.0 110.712 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.717 HD11 HD13 ' A' ' 36' ' ' LEU . 3.0 mp -136.09 125.16 38.63 Favored 'Isoleucine or valine' 0 C--N 1.358 0.972 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -150.98 127.39 10.69 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 103.285 -2.857 . . . . 0.0 103.285 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -179.83 -172.36 43.77 Favored Glycine 0 CA--C 1.493 -1.313 0 N-CA-C 108.539 -1.824 . . . . 0.0 108.539 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 51.1 m -121.09 115.72 23.63 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -95.72 132.47 40.88 Favored 'General case' 0 C--N 1.355 0.812 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.25 22.52 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-O 122.663 1.22 . . . . 0.0 110.146 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.506 HG13 ' HB3' ' A' ' 104' ' ' TYR . 91.6 t -101.21 115.56 43.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 N-CA-C 104.334 -2.469 . . . . 0.0 104.334 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -70.61 136.56 49.26 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.52 -6.1 57.36 Favored Glycine 0 C--N 1.359 1.839 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.1 -103.38 0.4 Allowed Glycine 0 C--N 1.355 1.604 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.12 160.87 24.46 Favored Pre-proline 0 N--CA 1.448 -0.563 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -177.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.9 126.17 10.46 Favored 'Trans proline' 0 CA--C 1.513 -0.528 0 C-N-CA 121.353 1.369 . . . . 0.0 113.403 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 2.7 pt -109.47 137.42 41.69 Favored 'Isoleucine or valine' 0 C--N 1.357 0.913 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 59.7 m -65.84 143.93 57.16 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-O 122.078 0.942 . . . . 0.0 111.466 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -140.92 144.42 35.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.9 t -129.2 131.96 67.32 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 N-CA-C 106.486 -1.672 . . . . 0.0 106.486 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.64 130.15 29.63 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.5 m -128.12 131.09 49.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.505 1.145 . . . . 0.0 109.554 -177.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -110.95 124.36 51.98 Favored 'General case' 0 C--N 1.354 0.791 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.5 m -152.01 147.56 26.66 Favored 'General case' 0 CA--C 1.488 -1.413 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -71.19 100.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-O 122.694 1.235 . . . . 0.0 110.765 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.7 p -99.87 161.86 22.97 Favored Pre-proline 0 C--N 1.354 0.767 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 178.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -51.29 153.78 9.22 Favored 'Trans proline' 0 C--O 1.206 -1.122 0 C-N-CA 122.151 1.9 . . . . 0.0 115.721 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.6 tp -46.45 -54.31 19.2 Favored Pre-proline 0 CA--C 1.549 0.918 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -74.1 -6.9 19.18 Favored 'Trans proline' 0 C--N 1.353 0.77 0 CA-C-N 121.321 1.507 . . . . 0.0 112.946 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.35 24.97 10.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.333 -0.849 . . . . 0.0 108.962 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -73.63 68.91 1.24 Allowed 'General case' 0 C--N 1.379 1.877 0 CA-C-O 121.927 0.87 . . . . 0.0 109.471 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.7 mtt -120.5 154.11 35.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.916 0.865 . . . . 0.0 109.896 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 79.3 m -96.33 137.03 36.0 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 -112.69 130.16 56.15 Favored 'General case' 0 C--N 1.36 1.057 0 CA-C-N 122.261 2.301 . . . . 0.0 109.385 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.5 t -123.36 138.77 54.53 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -120.07 125.25 47.84 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.6 mt -128.43 140.24 51.94 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.5 pm0 -127.97 142.9 51.11 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 178.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -91.1 124.2 35.14 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.534 -0.729 . . . . 0.0 110.793 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 60.87 24.15 14.15 Favored 'General case' 0 C--N 1.374 1.649 0 C-N-CA 124.176 0.99 . . . . 0.0 110.995 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 63.38 26.89 15.15 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 123.344 0.658 . . . . 0.0 110.534 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -93.11 122.36 35.4 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.76 -16.16 63.72 Favored 'General case' 0 C--N 1.352 0.698 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -88.0 -2.88 58.88 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 120.863 -1.148 . . . . 0.0 109.466 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.2 mt -124.05 94.87 4.35 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 -178.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 74.2 p -128.67 151.05 49.96 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-O 121.755 0.788 . . . . 0.0 109.174 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -137.4 132.52 33.6 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.83 111.62 18.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 103.489 -2.782 . . . . 0.0 103.489 177.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.8 mm -119.3 117.82 55.38 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.985 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.2 139.63 44.67 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -152.92 162.64 25.87 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -52.55 149.27 24.56 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 C-N-CA 122.389 2.059 . . . . 0.0 112.298 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -59.52 -19.82 50.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.964 -1.085 . . . . 0.0 113.814 -174.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -88.77 -45.58 9.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -71.53 -35.45 70.69 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.197 0.599 . . . . 0.0 111.068 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -62.72 -38.99 92.67 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 123.033 0.533 . . . . 0.0 111.673 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.03 -26.38 67.49 Favored 'General case' 0 C--O 1.207 -1.18 0 O-C-N 120.286 -1.509 . . . . 0.0 110.619 -177.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.99 -40.77 97.14 Favored 'General case' 0 C--N 1.374 1.647 0 CA-C-N 119.993 1.27 . . . . 0.0 108.585 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -61.99 -47.11 86.29 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 123.935 0.894 . . . . 0.0 109.507 175.517 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.1 tp -60.89 -42.69 98.48 Favored 'General case' 0 C--N 1.357 0.929 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.739 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -45.95 97.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.416 -0.803 . . . . 0.0 109.653 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.71 -41.25 99.05 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.481 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 66.4 ttp -63.07 -48.7 77.5 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 122.686 0.394 . . . . 0.0 111.092 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -66.35 -45.95 78.44 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-O 121.604 0.716 . . . . 0.0 109.9 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.85 -50.33 71.35 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.157 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.12 -45.1 97.23 Favored Glycine 0 C--N 1.359 1.83 0 CA-C-O 119.123 -0.821 . . . . 0.0 115.112 -174.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.506 ' HB3' HG13 ' A' ' 48' ' ' VAL . 76.4 m-85 -84.57 -33.59 23.38 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-N 119.827 1.813 . . . . 0.0 111.867 -176.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -82.13 -49.52 10.07 Favored 'General case' 0 C--N 1.349 0.574 0 O-C-N 120.851 -1.156 . . . . 0.0 111.672 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -64.54 -43.82 92.75 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -85.22 -22.08 28.83 Favored 'General case' 0 C--N 1.367 1.33 0 O-C-N 120.684 -1.26 . . . . 0.0 110.704 -176.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 61.46 40.84 13.41 Favored 'General case' 0 C--N 1.367 1.364 0 CA-C-O 122.434 1.112 . . . . 0.0 110.461 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -125.46 147.57 49.16 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.386 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.4 p -91.06 -10.86 40.58 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -81.99 118.75 23.23 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -85.48 151.39 55.98 Favored Pre-proline 0 C--N 1.347 0.491 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -62.53 141.12 85.2 Favored 'Trans proline' 0 N--CA 1.473 0.322 0 C-N-CA 121.508 1.472 . . . . 0.0 113.078 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.6 -38.94 96.68 Favored Glycine 0 C--N 1.356 1.667 0 O-C-N 121.934 -0.478 . . . . 0.0 112.827 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.24 -29.45 63.95 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 118.811 1.305 . . . . 0.0 109.654 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.93 -35.32 67.0 Favored 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -70.75 -22.46 62.4 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 121.795 -0.566 . . . . 0.0 110.177 -178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -62.74 -45.77 91.16 Favored 'General case' 0 C--N 1.364 1.223 0 CA-C-O 122.136 0.969 . . . . 0.0 108.964 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.89 -40.21 96.85 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.809 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.62 -43.45 69.24 Favored 'General case' 0 C--N 1.358 0.978 0 O-C-N 122.065 -0.397 . . . . 0.0 110.385 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 55.6 tp -66.93 -40.67 87.66 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.834 0.454 . . . . 0.0 110.272 -179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.364 2.121 0 N-CA-C 110.039 -1.224 . . . . 0.0 110.039 179.304 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.7 ptt-85 . . . . . 0 C--O 1.236 0.356 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.9 pt -63.49 -21.59 28.83 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -79.44 -8.92 59.46 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 121.083 -1.011 . . . . 0.0 111.041 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -101.79 -1.62 31.93 Favored 'General case' 0 C--N 1.36 1.029 0 O-C-N 121.599 -0.688 . . . . 0.0 109.499 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.9 mt -102.77 -120.45 0.19 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-O 121.966 0.888 . . . . 0.0 108.785 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.719 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -89.23 158.43 46.49 Favored Pre-proline 0 C--N 1.347 0.459 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 179.551 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.719 ' HD2' HG22 ' A' ' 7' ' ' VAL . 88.6 Cg_exo -53.99 126.59 22.52 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 120.821 1.014 . . . . 0.0 112.617 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.07 118.8 18.42 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 123.2 1.476 . . . . 0.0 112.067 -176.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -84.24 160.74 56.59 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-N 113.372 -1.74 . . . . 0.0 106.909 176.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.08 -19.03 61.46 Favored 'Trans proline' 0 N--CA 1.486 1.072 0 C-N-CA 122.039 1.826 . . . . 0.0 113.416 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -76.5 -53.07 8.6 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.19 -46.59 79.33 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 125.436 1.495 . . . . 0.0 110.823 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -60.96 -42.67 93.77 Favored 'Isoleucine or valine' 0 C--N 1.349 0.576 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.9 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.3 m -71.52 -36.56 71.07 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.385 -176.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.2 mt -70.51 -40.67 73.37 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 121.656 -0.652 . . . . 0.0 110.323 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -72.42 -22.14 61.15 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -59.34 -54.58 54.78 Favored Pre-proline 0 N--CA 1.485 1.325 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo . . . . . 0 C--N 1.349 0.56 0 CA-C-N 121.308 1.503 . . . . 0.0 114.266 179.331 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 CA--C 1.532 0.277 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.0 tp -67.14 -56.02 14.33 Favored Pre-proline 0 C--N 1.365 1.245 0 O-C-N 121.238 -0.914 . . . . 0.0 112.9 -177.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.99 -18.31 31.33 Favored 'Trans proline' 0 C--N 1.356 0.974 0 CA-C-N 121.112 1.433 . . . . 0.0 114.046 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -69.41 -36.1 76.41 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.56 -18.48 59.74 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.932 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.91 -36.18 82.67 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 121.412 -0.805 . . . . 0.0 108.905 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -64.27 -38.25 90.36 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.001 -0.437 . . . . 0.0 110.044 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.573 ' CD2' HD11 ' A' ' 42' ' ' ILE . 7.5 mp -68.31 -43.98 76.42 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -55.01 -28.42 51.93 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 124.763 1.225 . . . . 0.0 112.602 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -65.09 -19.94 66.23 Favored 'General case' 0 C--N 1.361 1.099 0 O-C-N 121.257 -0.902 . . . . 0.0 111.064 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.23 11.21 7.58 Favored Glycine 0 C--N 1.36 1.915 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.3 m -65.73 -43.84 87.81 Favored 'General case' 0 C--N 1.361 1.088 0 CA-C-N 117.552 0.676 . . . . 0.0 109.437 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.9 m 65.28 173.94 0.21 Allowed 'General case' 0 C--N 1.375 1.675 0 CA-C-O 121.969 0.89 . . . . 0.0 111.356 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.573 HD11 ' CD2' ' A' ' 36' ' ' LEU . 2.7 mp -136.24 127.06 42.37 Favored 'Isoleucine or valine' 0 C--N 1.36 1.024 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -151.47 126.03 9.52 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 103.187 -2.894 . . . . 0.0 103.187 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.75 -169.19 41.08 Favored Glycine 0 CA--C 1.492 -1.367 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 p -121.54 115.9 23.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -92.56 130.45 38.2 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.85 118.49 22.41 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 122.874 1.321 . . . . 0.0 110.746 -176.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.443 HG13 ' HB3' ' A' ' 104' ' ' TYR . 93.4 t -99.01 109.55 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 176.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -70.31 132.5 45.78 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.59 -8.69 58.48 Favored Glycine 0 C--N 1.358 1.787 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.14 -107.12 0.9 Allowed Glycine 0 C--N 1.355 1.628 0 N-CA-C 108.668 -1.773 . . . . 0.0 108.668 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.5 157.98 24.69 Favored Pre-proline 0 N--CA 1.445 -0.697 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.78 124.95 9.12 Favored 'Trans proline' 0 CA--C 1.514 -0.508 0 C-N-CA 121.156 1.237 . . . . 0.0 112.891 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 pt -109.34 136.8 44.13 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 CA-C-O 122.055 0.931 . . . . 0.0 108.866 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.8 m -65.62 141.34 58.44 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-O 122.127 0.965 . . . . 0.0 111.918 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -140.74 144.09 35.33 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -130.49 131.89 64.9 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.412 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -138.35 131.96 30.8 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 176.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 66.8 p -129.56 157.88 40.84 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.31 1.053 . . . . 0.0 109.431 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -121.74 133.79 54.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 95.6 m -155.89 140.75 17.17 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.68 100.86 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-O 122.503 1.145 . . . . 0.0 109.924 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -99.54 164.44 16.61 Favored Pre-proline 0 C--N 1.354 0.786 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -52.41 155.76 9.27 Favored 'Trans proline' 0 C--O 1.206 -1.123 0 C-N-CA 122.249 1.966 . . . . 0.0 115.649 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.26 -53.66 37.25 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.04 -6.64 18.83 Favored 'Trans proline' 0 C--N 1.351 0.707 0 CA-C-N 121.247 1.481 . . . . 0.0 112.704 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.18 24.54 11.09 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.845 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.92 71.0 2.71 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -120.74 153.27 37.22 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.965 0.888 . . . . 0.0 109.976 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -95.38 135.17 37.33 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 178.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -111.11 131.32 55.18 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 121.94 2.154 . . . . 0.0 109.536 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.4 t -125.2 136.94 54.07 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.28 125.24 53.05 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.2 mt -126.55 129.18 48.09 Favored 'General case' 0 C--N 1.353 0.758 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.04 137.86 40.67 Favored 'General case' 0 C--N 1.356 0.874 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -85.79 110.04 19.08 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 121.369 -0.832 . . . . 0.0 109.667 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.0 t30 65.55 26.61 11.67 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 123.707 0.803 . . . . 0.0 109.948 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 65.08 24.1 12.48 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 123.519 0.728 . . . . 0.0 110.873 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.28 115.84 28.43 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.36 -26.08 68.25 Favored 'General case' 0 C--N 1.356 0.88 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -75.34 -14.62 60.49 Favored 'General case' 0 C--N 1.362 1.135 0 O-C-N 121.307 -0.871 . . . . 0.0 109.713 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.8 mt -116.53 84.26 2.1 Favored 'General case' 0 C--N 1.351 0.637 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.6 m -119.63 129.68 54.71 Favored 'General case' 0 C--N 1.361 1.081 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -109.39 133.17 53.4 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.58 109.29 15.99 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 103.467 -2.79 . . . . 0.0 103.467 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -119.02 117.7 55.15 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -176.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.34 140.63 45.22 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.3 mp -154.2 161.57 28.97 Favored Pre-proline 0 C--O 1.242 0.666 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 -179.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -53.27 145.91 42.37 Favored 'Trans proline' 0 CA--C 1.508 -0.813 0 C-N-CA 122.059 1.839 . . . . 0.0 111.788 176.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -60.51 -20.21 59.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.084 -1.01 . . . . 0.0 113.51 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -87.95 -22.82 24.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.682 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -95.69 -33.71 12.22 Favored 'General case' 0 C--N 1.361 1.084 0 O-C-N 121.821 -0.549 . . . . 0.0 111.069 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.85 -41.22 97.57 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -175.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.7 -32.7 73.83 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 120.678 -1.264 . . . . 0.0 111.228 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.36 -41.16 79.58 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.688 1.131 . . . . 0.0 109.753 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -66.87 -41.35 87.44 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 121.698 -0.626 . . . . 0.0 109.951 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -43.05 98.97 Favored 'General case' 0 C--N 1.357 0.921 0 CA-C-O 120.525 0.202 . . . . 0.0 111.018 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -43.84 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.642 -0.661 . . . . 0.0 109.378 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.99 -40.65 96.36 Favored 'General case' 0 C--N 1.363 1.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.056 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.9 ttp -62.66 -47.92 81.57 Favored 'General case' 0 C--N 1.356 0.855 0 CA-C-O 120.995 0.426 . . . . 0.0 110.794 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.87 -44.73 80.18 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 121.516 0.674 . . . . 0.0 109.709 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -62.17 -48.64 79.16 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.293 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.73 -46.6 93.34 Favored Glycine 0 C--N 1.354 1.562 0 O-C-N 121.243 -0.911 . . . . 0.0 113.753 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.443 ' HB3' HG13 ' A' ' 48' ' ' VAL . 56.4 m-85 -87.46 -39.28 15.35 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 119.54 1.67 . . . . 0.0 113.436 -176.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -82.51 -52.17 7.11 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.249 -1.532 . . . . 0.0 112.036 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -63.68 -41.75 98.13 Favored 'General case' 0 C--N 1.357 0.927 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 22.4 mmt -87.53 -22.72 24.69 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 121.017 -1.052 . . . . 0.0 110.714 -176.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 61.12 36.63 18.14 Favored 'General case' 0 C--N 1.366 1.31 0 CA-C-O 122.327 1.061 . . . . 0.0 110.854 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -116.16 140.37 49.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.327 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 t -89.19 -7.42 55.65 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -86.34 108.86 18.63 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -78.86 151.96 76.94 Favored Pre-proline 0 C--N 1.351 0.661 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.66 139.58 76.15 Favored 'Trans proline' 0 CA--C 1.517 -0.337 0 C-N-CA 121.668 1.579 . . . . 0.0 113.434 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.42 96.05 Favored Glycine 0 C--N 1.357 1.727 0 O-C-N 121.903 -0.498 . . . . 0.0 112.388 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.4 -34.07 75.38 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.612 1.206 . . . . 0.0 109.943 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -70.14 -40.03 75.05 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -71.21 -30.41 66.35 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 121.946 -0.471 . . . . 0.0 110.332 -178.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -60.72 -49.73 76.33 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.756 0.788 . . . . 0.0 110.05 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -67.16 -41.47 85.94 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.347 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.14 -41.27 74.1 Favored 'General case' 0 C--N 1.357 0.921 0 O-C-N 121.889 -0.507 . . . . 0.0 111.108 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.0 tp -69.71 -40.22 76.39 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 121.713 -0.617 . . . . 0.0 109.91 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.223 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.796 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 . . . . . 0 CA--C 1.518 -0.255 0 CA-C-O 121.736 0.779 . . . . 0.0 109.138 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.8 mm -61.47 -36.7 74.86 Favored 'Isoleucine or valine' 0 C--N 1.364 1.204 0 C-N-CA 124.088 0.955 . . . . 0.0 110.705 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -63.52 -15.06 56.87 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -176.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -91.69 -4.43 55.15 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 121.44 -0.787 . . . . 0.0 109.323 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.3 mt -106.37 -107.44 0.31 Allowed 'General case' 0 C--N 1.35 0.59 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.708 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -90.69 158.01 43.14 Favored Pre-proline 0 C--N 1.345 0.401 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 179.259 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.708 ' HD2' HG22 ' A' ' 7' ' ' VAL . 75.3 Cg_exo -56.5 128.11 28.7 Favored 'Trans proline' 0 N--CA 1.477 0.537 0 CA-C-N 119.703 0.93 . . . . 0.0 112.416 176.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.14 119.82 24.07 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 123.138 1.447 . . . . 0.0 111.905 -176.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -83.5 162.72 52.54 Favored Pre-proline 0 N--CA 1.443 -0.805 0 CA-C-N 113.484 -1.689 . . . . 0.0 106.716 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -55.86 -26.52 58.07 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 122.361 2.04 . . . . 0.0 113.401 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -72.54 -50.52 25.1 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 108.578 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -46.01 85.37 Favored 'General case' 0 C--N 1.363 1.169 0 C-N-CA 125.612 1.565 . . . . 0.0 110.935 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -61.04 -43.24 95.76 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.685 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.9 m -71.91 -36.86 70.11 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.187 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.22 -39.1 82.45 Favored 'General case' 0 C--N 1.37 1.461 0 O-C-N 121.325 -0.859 . . . . 0.0 110.199 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.403 ' CD1' HD21 ' A' ' 34' ' ' LEU . 70.3 t80 -74.24 -16.27 60.96 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.817 -0.552 . . . . 0.0 112.184 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.7 m -61.8 -52.03 71.59 Favored Pre-proline 0 N--CA 1.486 1.372 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo . . . . . 0 N--CA 1.487 1.113 0 CA-C-N 121.553 1.59 . . . . 0.0 115.439 179.832 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 . . . . . 0 N--CA 1.466 0.337 0 N-CA-C 111.584 0.216 . . . . 0.0 111.584 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.9 tp -64.1 -57.06 19.7 Favored Pre-proline 0 C--N 1.365 1.24 0 O-C-N 121.463 -0.773 . . . . 0.0 112.399 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.92 -17.26 32.45 Favored 'Trans proline' 0 C--N 1.355 0.921 0 CA-C-N 120.638 1.263 . . . . 0.0 114.957 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -68.32 -37.19 80.33 Favored 'General case' 0 C--N 1.359 1.007 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.44 -18.5 60.63 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 121.957 -0.465 . . . . 0.0 110.039 -177.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.403 HD21 ' CD1' ' A' ' 17' ' ' TYR . 94.5 mt -72.38 -22.32 61.15 Favored 'General case' 0 C--N 1.36 1.051 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 66.0 m -84.77 -25.39 28.25 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.591 ' CD2' HD11 ' A' ' 42' ' ' ILE . 6.4 mp -74.92 -41.34 59.88 Favored 'General case' 0 C--N 1.358 0.958 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.97 -29.14 59.78 Favored 'General case' 0 C--N 1.358 0.94 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.638 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -64.01 -13.32 45.83 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 121.285 -0.884 . . . . 0.0 112.79 -177.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.64 2.36 14.82 Favored Glycine 0 C--N 1.376 2.777 0 CA-C-N 119.953 1.251 . . . . 0.0 110.854 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.6 m -70.4 -42.17 72.04 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-N 118.531 1.165 . . . . 0.0 109.975 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 t 64.83 -175.9 0.17 Allowed 'General case' 0 C--N 1.372 1.572 0 CA-C-O 121.477 0.656 . . . . 0.0 110.943 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.591 HD11 ' CD2' ' A' ' 36' ' ' LEU . 2.8 mp -138.27 125.97 29.03 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -152.35 126.91 9.41 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.451 -2.796 . . . . 0.0 103.451 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.83 -169.02 40.8 Favored Glycine 0 CA--C 1.494 -1.245 0 N-CA-C 108.667 -1.773 . . . . 0.0 108.667 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 68.8 m -122.1 117.17 25.65 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -95.04 130.78 41.58 Favored 'General case' 0 C--N 1.355 0.807 0 N-CA-C 107.424 -1.325 . . . . 0.0 107.424 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.93 118.71 23.17 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-O 122.725 1.25 . . . . 0.0 109.8 -177.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.566 HG13 ' HB3' ' A' ' 104' ' ' TYR . 81.4 t -101.86 115.33 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.236 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 177.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -71.13 138.46 49.67 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.628 0.728 . . . . 0.0 109.479 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.21 -8.55 62.8 Favored Glycine 0 C--N 1.36 1.874 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.97 -103.53 0.55 Allowed Glycine 0 C--N 1.356 1.642 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.83 159.48 22.32 Favored Pre-proline 0 N--CA 1.447 -0.58 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.18 123.72 7.99 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.382 1.388 . . . . 0.0 112.84 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.4 pt -109.1 137.1 42.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.841 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 77.3 p -67.78 148.02 51.8 Favored 'General case' 0 C--N 1.364 1.206 0 CA-C-O 122.695 1.236 . . . . 0.0 112.188 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -145.8 146.52 31.21 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -129.86 130.76 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.75 135.79 35.06 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -134.99 154.1 51.85 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.406 1.098 . . . . 0.0 109.781 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.26 124.94 35.72 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.8 m -152.63 151.48 30.66 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 103.311 -2.848 . . . . 0.0 103.311 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.57 101.31 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 122.525 1.155 . . . . 0.0 111.177 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.1 p -99.25 157.34 34.21 Favored Pre-proline 0 C--N 1.352 0.717 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 176.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -50.46 151.05 10.58 Favored 'Trans proline' 0 CA--C 1.498 -1.293 0 C-N-CA 122.092 1.862 . . . . 0.0 115.586 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 tp -45.74 -52.97 22.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.01 -6.66 18.87 Favored 'Trans proline' 0 C--N 1.352 0.746 0 CA-C-N 121.582 1.601 . . . . 0.0 113.127 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.6 25.91 10.08 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 43.8 p-10 -72.67 63.41 0.6 Allowed 'General case' 0 C--N 1.374 1.635 0 CA-C-O 121.822 0.82 . . . . 0.0 111.328 -177.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -116.39 153.39 32.13 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 122.107 0.956 . . . . 0.0 110.244 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.8 m -96.72 135.8 38.14 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 104.829 -2.286 . . . . 0.0 104.829 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -113.32 132.51 55.54 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.285 2.311 . . . . 0.0 109.914 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 12.3 t -125.73 138.3 53.86 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -115.88 125.05 52.11 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 177.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.5 mt -127.07 128.15 45.82 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -104.84 135.78 45.57 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -85.99 114.3 22.77 Favored 'General case' 0 C--N 1.345 0.409 0 O-C-N 121.398 -0.814 . . . . 0.0 109.622 -177.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 63.58 25.52 14.39 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 123.825 0.85 . . . . 0.0 110.552 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 63.71 27.82 14.82 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 123.452 0.701 . . . . 0.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -96.36 114.29 25.95 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.03 -25.52 67.71 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -74.0 -16.71 61.05 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.265 -0.897 . . . . 0.0 109.416 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.7 mt -114.55 80.84 1.46 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 106.851 -1.536 . . . . 0.0 106.851 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.7 m -118.87 128.56 54.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -177.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -110.0 133.43 53.2 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -117.45 109.66 17.03 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 103.224 -2.88 . . . . 0.0 103.224 178.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.0 mm -118.82 118.74 58.79 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.165 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.14 141.57 45.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mp -150.67 160.32 32.77 Favored Pre-proline 0 CA--C 1.51 -0.562 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 -178.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -52.78 149.73 24.57 Favored 'Trans proline' 0 N--CA 1.482 0.848 0 C-N-CA 122.116 1.877 . . . . 0.0 111.273 176.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -62.35 -18.49 61.62 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.701 -1.25 . . . . 0.0 113.778 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -88.94 -22.94 22.82 Favored 'General case' 0 C--N 1.35 0.619 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -95.31 -30.13 14.11 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 122.002 -0.436 . . . . 0.0 110.772 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -64.66 -40.17 94.96 Favored 'General case' 0 C--N 1.364 1.196 0 O-C-N 121.919 -0.488 . . . . 0.0 111.62 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.28 -37.81 88.83 Favored 'General case' 0 C--N 1.36 1.041 0 O-C-N 120.355 -1.466 . . . . 0.0 109.814 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -58.98 -41.18 86.95 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 120.051 1.296 . . . . 0.0 109.487 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -61.03 -48.98 79.25 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 123.828 0.851 . . . . 0.0 109.939 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -40.94 88.16 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.021 0.528 . . . . 0.0 112.133 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.8 -46.91 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.57 -0.706 . . . . 0.0 109.851 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.77 -42.55 99.74 Favored 'General case' 0 C--N 1.359 0.994 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.395 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 64.2 ttp -63.52 -48.32 78.02 Favored 'General case' 0 C--N 1.356 0.873 0 CA-C-O 121.006 0.431 . . . . 0.0 110.859 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.6 tp -64.75 -49.16 71.88 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.367 0.603 . . . . 0.0 110.532 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.3 ttp -61.78 -50.28 72.97 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 122.834 0.453 . . . . 0.0 112.035 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.36 -44.69 97.72 Favored Glycine 0 C--N 1.359 1.812 0 CA-C-O 119.048 -0.862 . . . . 0.0 114.748 -174.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.566 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.0 m-85 -84.6 -32.3 23.82 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.707 1.753 . . . . 0.0 112.085 -176.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -83.47 -50.63 8.1 Favored 'General case' 0 C--N 1.35 0.592 0 O-C-N 120.79 -1.194 . . . . 0.0 111.5 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.8 ttt180 -63.37 -42.49 98.87 Favored 'General case' 0 C--N 1.358 0.97 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 38.7 mmt -82.33 -21.33 36.08 Favored 'General case' 0 C--N 1.368 1.407 0 O-C-N 120.757 -1.215 . . . . 0.0 110.395 -177.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 60.93 39.06 17.15 Favored 'General case' 0 C--N 1.369 1.427 0 CA-C-O 122.472 1.13 . . . . 0.0 110.494 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -137.32 145.69 43.72 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.033 -1.44 . . . . 0.0 107.239 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.3 m -95.83 56.34 1.72 Allowed 'General case' 0 C--N 1.358 0.939 0 CA-C-O 122.308 1.051 . . . . 0.0 108.252 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -127.09 132.95 50.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -105.55 148.15 35.87 Favored Pre-proline 0 C--N 1.349 0.582 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -65.06 141.56 70.61 Favored 'Trans proline' 0 CA--C 1.518 -0.287 0 C-N-CA 121.255 1.303 . . . . 0.0 112.191 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -39.56 97.42 Favored Glycine 0 C--N 1.357 1.731 0 O-C-N 121.818 -0.551 . . . . 0.0 112.769 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.33 -31.59 68.95 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 118.637 1.218 . . . . 0.0 109.926 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -71.16 -33.26 69.86 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -73.53 -17.46 61.2 Favored 'General case' 0 C--N 1.363 1.19 0 O-C-N 121.596 -0.69 . . . . 0.0 111.005 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -65.96 -43.01 89.18 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -64.76 -39.07 93.01 Favored 'General case' 0 C--N 1.353 0.725 0 CA-C-N 113.168 -1.833 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.12 -43.84 66.82 Favored 'General case' 0 C--N 1.359 0.983 0 O-C-N 121.839 -0.538 . . . . 0.0 110.202 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.5 tp -68.25 -40.62 81.88 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.696 0.398 . . . . 0.0 110.551 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.898 0 N-CA-C 107.918 -2.073 . . . . 0.0 107.918 -178.886 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 . . . . . 0 CA--C 1.514 -0.422 0 CA-C-O 122.068 0.937 . . . . 0.0 109.609 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.0 pt -70.5 -14.15 17.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.478 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.49 -10.47 59.82 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 121.082 -1.011 . . . . 0.0 110.168 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -91.03 -4.66 56.19 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.8 mt -107.16 -114.25 0.27 Allowed 'General case' 0 C--N 1.354 0.783 0 CA-C-O 121.851 0.834 . . . . 0.0 108.773 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.721 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -89.98 157.94 45.15 Favored Pre-proline 0 C--N 1.346 0.445 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.721 ' HD2' HG22 ' A' ' 7' ' ' VAL . 71.2 Cg_exo -56.04 128.8 31.74 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 120.845 1.03 . . . . 0.0 112.283 176.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.86 118.5 20.95 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-O 123.309 1.528 . . . . 0.0 112.552 -175.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -84.78 161.56 52.91 Favored Pre-proline 0 N--CA 1.443 -0.81 0 CA-C-N 113.252 -1.795 . . . . 0.0 106.328 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.41 -18.18 51.86 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 122.036 1.824 . . . . 0.0 113.568 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -79.07 -52.86 7.63 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.04 1.336 . . . . 0.0 107.624 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.9 -45.93 74.76 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 125.564 1.546 . . . . 0.0 110.987 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.6 t -60.45 -41.17 86.56 Favored 'Isoleucine or valine' 0 C--N 1.351 0.66 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.242 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 60.6 m -78.85 -19.26 52.45 Favored 'General case' 0 C--N 1.365 1.252 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.794 -175.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.2 mt -83.92 -43.38 15.32 Favored 'General case' 0 C--N 1.368 1.371 0 CA-C-N 119.283 0.947 . . . . 0.0 108.615 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -65.32 -42.25 93.18 Favored 'General case' 0 C--N 1.352 0.687 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 56.5 m -53.26 -53.15 59.22 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo . . . . . 0 C--O 1.233 0.252 0 CA-C-N 121.551 1.59 . . . . 0.0 113.859 179.301 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.4 tp -62.39 -51.61 72.11 Favored Pre-proline 0 C--N 1.358 0.936 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.7 -23.01 63.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-N 121.048 1.41 . . . . 0.0 115.633 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -76.69 -28.7 55.99 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 121.359 -0.838 . . . . 0.0 108.838 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.78 -18.65 50.5 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.43 -16.95 61.3 Favored 'General case' 0 C--N 1.359 0.999 0 O-C-N 121.001 -1.062 . . . . 0.0 108.658 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.9 m -85.09 -17.19 38.12 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.55 ' CD2' HD11 ' A' ' 42' ' ' ILE . 7.7 mp -86.13 -47.67 9.3 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -67.3 -11.53 57.81 Favored 'General case' 0 C--N 1.363 1.17 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.051 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -73.11 -12.26 60.84 Favored 'General case' 0 C--N 1.362 1.109 0 O-C-N 120.749 -1.219 . . . . 0.0 109.034 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.6 10.23 9.54 Favored Glycine 0 C--N 1.377 2.85 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -71.24 -45.54 63.02 Favored 'General case' 0 C--N 1.355 0.848 0 CA-C-N 118.718 1.259 . . . . 0.0 110.935 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.5 t 66.56 177.17 0.23 Allowed 'General case' 0 C--N 1.374 1.636 0 CA-C-O 121.19 0.519 . . . . 0.0 109.795 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.55 HD11 ' CD2' ' A' ' 36' ' ' LEU . 1.6 mp -140.53 129.03 25.04 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 O-C-N 120.642 -1.287 . . . . 0.0 108.931 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -154.65 125.76 7.24 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.3 -168.74 40.65 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 108.545 -1.822 . . . . 0.0 108.545 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 p -121.15 114.92 22.13 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -93.95 131.2 39.64 Favored 'General case' 0 C--N 1.355 0.83 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.95 126.37 31.86 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.762 1.268 . . . . 0.0 109.522 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.501 HG13 ' HB3' ' A' ' 104' ' ' TYR . 93.4 t -110.46 116.85 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.0 mp0 -73.31 135.54 44.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 94.83 9.42 58.54 Favored Glycine 0 C--N 1.359 1.837 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.96 -107.89 0.26 Allowed Glycine 0 CA--C 1.492 -1.386 0 N-CA-C 109.045 -1.622 . . . . 0.0 109.045 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.4 159.19 20.59 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.93 122.55 7.31 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.32 1.347 . . . . 0.0 112.622 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.0 pt -109.97 137.27 42.99 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 CA-C-O 122.152 0.977 . . . . 0.0 108.776 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.9 m -65.19 140.76 58.79 Favored 'General case' 0 C--N 1.365 1.271 0 CA-C-O 122.143 0.973 . . . . 0.0 111.541 178.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.05 143.5 36.4 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.6 t -129.34 132.6 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.532 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -136.32 128.65 30.11 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 177.192 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 p -127.97 164.58 22.01 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.874 0.845 . . . . 0.0 108.779 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 65.1 p-90 -137.22 153.94 50.28 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.558 HG23 HG23 ' A' ' 63' ' ' THR . 15.3 t -164.41 148.04 9.32 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 176.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -76.62 99.5 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 122.593 1.187 . . . . 0.0 108.994 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.558 HG23 HG23 ' A' ' 61' ' ' THR . 1.1 p -99.84 160.49 27.15 Favored Pre-proline 0 C--N 1.356 0.853 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -51.79 153.46 11.41 Favored 'Trans proline' 0 CA--C 1.501 -1.128 0 C-N-CA 122.175 1.917 . . . . 0.0 115.401 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.0 tp -41.09 -54.78 5.43 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.45 -8.48 22.69 Favored 'Trans proline' 0 C--N 1.353 0.789 0 CA-C-N 121.494 1.569 . . . . 0.0 113.303 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.41 24.0 11.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.03 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.76 73.85 3.41 Favored 'General case' 0 C--N 1.375 1.704 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.4 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 58.7 mtt -123.98 153.86 40.65 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.043 0.925 . . . . 0.0 110.886 -176.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.7 m -92.84 137.84 32.01 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -115.13 129.68 56.73 Favored 'General case' 0 C--N 1.364 1.21 0 CA-C-N 122.006 2.184 . . . . 0.0 109.456 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 8.9 t -125.33 140.62 52.66 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-O 122.048 0.928 . . . . 0.0 108.714 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -118.85 124.24 46.67 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 mt -126.45 127.43 45.39 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -100.77 138.91 37.19 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 179.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -85.93 112.14 20.9 Favored 'General case' 0 C--N 1.347 0.47 0 O-C-N 121.395 -0.815 . . . . 0.0 109.113 -177.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.9 25.85 15.27 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 123.755 0.822 . . . . 0.0 110.58 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 66.44 22.48 10.71 Favored 'General case' 0 C--N 1.371 1.533 0 C-N-CA 123.555 0.742 . . . . 0.0 110.864 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -91.87 115.6 28.2 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.43 -24.98 67.72 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -75.55 -14.34 60.4 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 121.331 -0.856 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.0 mt -117.08 87.06 2.62 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -122.07 131.67 54.1 Favored 'General case' 0 C--N 1.359 1.022 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -108.54 130.56 55.28 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -118.54 107.88 14.3 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 103.082 -2.932 . . . . 0.0 103.082 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 51.3 mm -122.91 120.18 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.0 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 -175.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.81 140.12 45.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.4 mp -152.33 161.08 30.31 Favored Pre-proline 0 C--O 1.238 0.486 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.4 ' HA ' ' HA ' ' A' ' 69' ' ' MET . 82.7 Cg_exo -52.82 147.87 30.72 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.2 1.933 . . . . 0.0 112.571 177.313 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -19.27 58.11 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.926 -1.109 . . . . 0.0 112.893 -175.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.7 p-80 -89.43 -24.54 21.86 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 121.573 -0.704 . . . . 0.0 109.587 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.19 -34.42 12.92 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 121.14 0.495 . . . . 0.0 111.021 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.16 -39.32 92.26 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 123.254 0.622 . . . . 0.0 112.542 -176.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.36 -31.96 73.37 Favored 'General case' 0 C--O 1.203 -1.366 0 O-C-N 120.509 -1.37 . . . . 0.0 110.333 -177.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.34 -42.01 85.9 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 119.862 1.21 . . . . 0.0 109.425 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -61.96 -47.7 83.69 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 123.093 0.557 . . . . 0.0 109.543 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -43.55 98.38 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.712 -176.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -46.03 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 121.431 -0.793 . . . . 0.0 109.485 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.75 -42.64 97.79 Favored 'General case' 0 C--N 1.361 1.097 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.02 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.2 ttp -62.32 -50.14 72.83 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 123.166 0.586 . . . . 0.0 111.27 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -65.67 -48.02 73.5 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-O 121.397 0.618 . . . . 0.0 111.006 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mmt -63.79 -51.87 62.84 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.69 -44.87 95.75 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 -174.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.501 ' HB3' HG13 ' A' ' 48' ' ' VAL . 49.3 m-85 -75.78 -36.84 59.67 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 119.37 1.585 . . . . 0.0 110.738 -176.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -73.78 -45.15 53.45 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 121.793 -0.567 . . . . 0.0 110.845 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -65.35 -46.28 80.82 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.8 mtm -85.4 -22.34 28.42 Favored 'General case' 0 C--N 1.367 1.347 0 O-C-N 120.811 -1.181 . . . . 0.0 111.194 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 60.11 38.64 20.31 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-O 122.338 1.066 . . . . 0.0 110.752 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -137.18 139.52 41.17 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.2 m -94.45 56.31 2.1 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -137.41 108.36 6.71 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.65 154.8 39.81 Favored Pre-proline 0 C--N 1.354 0.764 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -59.96 146.61 95.5 Favored 'Trans proline' 0 N--CA 1.475 0.413 0 C-N-CA 122.027 1.818 . . . . 0.0 113.696 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -66.33 -16.6 65.13 Favored Glycine 0 C--N 1.361 1.966 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.949 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.2 -33.45 73.35 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-N 119.125 1.463 . . . . 0.0 109.3 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -72.6 -34.75 67.61 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -72.26 -23.72 61.25 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.947 -0.47 . . . . 0.0 110.306 -178.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -63.78 -50.45 68.97 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-O 122.122 0.963 . . . . 0.0 109.322 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -67.58 -40.31 84.83 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.193 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -40.15 82.29 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 122.473 0.309 . . . . 0.0 110.863 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 58.4 tp -68.86 -40.93 79.05 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 121.608 -0.683 . . . . 0.0 109.755 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.204 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 179.402 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 . . . . . 0 CA--C 1.511 -0.532 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.5 pt -70.82 -18.17 20.74 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.29 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -73.62 -12.57 60.79 Favored 'General case' 0 C--N 1.36 1.027 0 O-C-N 121.196 -0.94 . . . . 0.0 111.29 -177.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -95.98 -2.88 46.09 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 90.2 mt -104.27 -114.66 0.23 Allowed 'General case' 0 C--N 1.348 0.528 0 CA-C-O 121.947 0.879 . . . . 0.0 109.136 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.72 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -89.49 158.11 46.24 Favored Pre-proline 0 C--N 1.345 0.405 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.72 ' HD2' HG22 ' A' ' 7' ' ' VAL . 89.1 Cg_exo -54.84 127.81 27.78 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 120.797 0.998 . . . . 0.0 112.421 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.08 118.92 19.34 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-O 123.163 1.459 . . . . 0.0 112.5 -175.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -84.21 160.23 57.75 Favored Pre-proline 0 N--CA 1.442 -0.829 0 CA-C-N 113.384 -1.734 . . . . 0.0 106.421 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -61.46 -22.44 74.53 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 121.727 1.618 . . . . 0.0 112.666 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -73.14 -50.47 22.48 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.514 1.126 . . . . 0.0 108.647 177.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.09 -46.27 85.79 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 125.495 1.518 . . . . 0.0 110.872 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.8 t -60.64 -42.92 93.6 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.95 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -71.84 -36.5 70.18 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 119.065 -1.054 . . . . 0.0 110.466 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.6 mt -70.8 -40.28 72.63 Favored 'General case' 0 C--N 1.368 1.402 0 O-C-N 121.62 -0.675 . . . . 0.0 110.533 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -71.65 -24.68 61.9 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.0 m -58.5 -54.19 58.56 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo . . . . . 0 C--N 1.348 0.521 0 CA-C-N 121.435 1.548 . . . . 0.0 114.748 -179.678 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.91 -61.06 8.76 Favored Pre-proline 0 C--N 1.364 1.231 0 CA-C-N 119.112 0.869 . . . . 0.0 112.738 -177.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -73.26 -18.69 23.22 Favored 'Trans proline' 0 C--N 1.351 0.692 0 CA-C-N 120.473 1.205 . . . . 0.0 115.06 -179.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -72.85 -30.7 64.21 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 121.473 -0.767 . . . . 0.0 109.517 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.05 -18.07 56.26 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.8 mt -66.07 -36.58 83.58 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.515 -0.74 . . . . 0.0 109.028 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -63.08 -37.98 89.36 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.919 -0.488 . . . . 0.0 109.865 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.644 HD23 HD11 ' A' ' 42' ' ' ILE . 7.1 mp -68.41 -43.91 76.17 Favored 'General case' 0 C--N 1.361 1.091 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -56.27 -35.82 67.87 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.505 1.122 . . . . 0.0 112.09 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.87 -27.73 69.0 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.56 -0.713 . . . . 0.0 111.54 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 133.49 12.12 1.63 Allowed Glycine 0 C--N 1.354 1.572 0 C-N-CA 120.0 -1.095 . . . . 0.0 111.246 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.1 m -68.93 -43.45 75.1 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 118.817 1.309 . . . . 0.0 109.669 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 t 65.58 176.03 0.21 Allowed 'General case' 0 C--N 1.374 1.662 0 CA-C-O 121.7 0.762 . . . . 0.0 111.056 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.644 HD11 HD23 ' A' ' 36' ' ' LEU . 2.2 mp -139.05 125.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -151.43 125.59 9.3 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 103.016 -2.957 . . . . 0.0 103.016 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.04 -169.89 41.9 Favored Glycine 0 CA--C 1.491 -1.436 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 -178.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.0 m -121.25 115.28 22.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -92.19 130.6 37.87 Favored 'General case' 0 C--N 1.357 0.913 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.99 122.34 27.17 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 122.904 1.335 . . . . 0.0 110.277 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.627 HG13 ' HB3' ' A' ' 104' ' ' TYR . 96.6 t -106.15 115.87 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.275 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -71.33 139.28 49.82 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.631 0.729 . . . . 0.0 109.677 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.91 -8.96 63.63 Favored Glycine 0 C--N 1.361 1.961 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -140.1 -102.85 0.53 Allowed Glycine 0 C--N 1.354 1.581 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.65 158.97 22.83 Favored Pre-proline 0 N--CA 1.448 -0.545 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.64 126.25 9.44 Favored 'Trans proline' 0 CA--C 1.513 -0.535 0 C-N-CA 121.427 1.418 . . . . 0.0 112.789 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.6 pt -109.56 136.43 45.49 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 CA-C-O 122.042 0.925 . . . . 0.0 108.793 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 61.1 m -64.66 140.84 58.91 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 122.141 0.972 . . . . 0.0 112.041 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -140.58 143.88 35.54 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.1 t -129.88 131.08 66.59 Favored 'Isoleucine or valine' 0 C--N 1.353 0.743 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.96 129.29 27.72 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 176.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -128.73 132.29 47.96 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -178.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.61 127.79 50.98 Favored 'General case' 0 C--N 1.352 0.689 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.5 m -153.59 148.35 26.42 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 103.517 -2.771 . . . . 0.0 103.517 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.65 102.91 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.216 0 CA-C-O 122.446 1.117 . . . . 0.0 111.019 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.1 p -99.03 158.58 32.05 Favored Pre-proline 0 C--N 1.354 0.765 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -49.87 155.59 4.0 Favored 'Trans proline' 0 C--O 1.203 -1.274 0 C-N-CA 122.605 2.204 . . . . 0.0 115.831 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.58 -51.15 75.99 Favored Pre-proline 0 N--CA 1.474 0.737 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.76 -4.57 15.61 Favored 'Trans proline' 0 CA--C 1.512 -0.577 0 CA-C-N 121.162 1.451 . . . . 0.0 112.15 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.93 26.15 9.87 Favored 'General case' 0 C--N 1.348 0.516 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.383 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.6 p-10 -73.02 61.94 0.6 Allowed 'General case' 0 C--N 1.374 1.633 0 CA-C-O 121.86 0.838 . . . . 0.0 111.184 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.426 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 58.9 mtt -117.44 153.29 33.36 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 122.003 0.906 . . . . 0.0 110.02 -177.358 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.9 m -96.1 135.46 37.86 Favored 'General case' 0 C--N 1.354 0.801 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 -111.5 132.03 54.79 Favored 'General case' 0 C--N 1.36 1.06 0 CA-C-N 122.095 2.225 . . . . 0.0 109.896 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.2 t -125.62 138.72 53.93 Favored 'General case' 0 C--N 1.35 0.616 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -116.63 125.19 51.43 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.33 130.73 50.02 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -104.48 138.94 40.11 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -85.85 113.29 21.88 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 121.232 -0.917 . . . . 0.0 109.477 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.9 t30 63.24 26.64 15.25 Favored 'General case' 0 C--N 1.373 1.596 0 C-N-CA 123.584 0.754 . . . . 0.0 110.018 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 65.68 23.49 11.6 Favored 'General case' 0 C--N 1.372 1.584 0 C-N-CA 123.557 0.743 . . . . 0.0 110.978 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -92.82 115.41 28.08 Favored 'General case' 0 C--N 1.353 0.759 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.98 -24.41 67.89 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -74.29 -16.48 60.93 Favored 'General case' 0 C--N 1.362 1.112 0 O-C-N 121.342 -0.849 . . . . 0.0 109.29 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.0 mt -115.48 87.21 2.62 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.5 m -120.7 130.5 54.11 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -177.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -109.23 132.69 53.89 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -119.01 108.5 14.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 103.23 -2.878 . . . . 0.0 103.23 177.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.7 mm -120.36 119.51 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.92 141.86 46.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.48 160.66 31.45 Favored Pre-proline 0 C--O 1.238 0.467 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 69' ' ' MET . 80.1 Cg_exo -53.83 151.2 26.99 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 122.246 1.964 . . . . 0.0 111.889 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.88 -18.02 53.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.639 -1.288 . . . . 0.0 113.312 -175.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -89.62 -28.45 19.5 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.359 -0.838 . . . . 0.0 108.89 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -92.26 -28.66 16.85 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 121.7 -0.625 . . . . 0.0 111.015 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.32 -38.75 92.15 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 121.676 -0.64 . . . . 0.0 111.591 -177.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.405 ' O ' HG13 ' A' ' 98' ' ' ILE . 8.6 mp -66.45 -32.89 74.54 Favored 'General case' 0 C--O 1.202 -1.426 0 O-C-N 120.488 -1.382 . . . . 0.0 109.66 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.58 -42.52 88.2 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 119.864 1.211 . . . . 0.0 109.024 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -62.65 -48.75 77.98 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.936 0.894 . . . . 0.0 110.243 175.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -43.08 99.44 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -176.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -63.54 -41.03 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 121.343 -0.848 . . . . 0.0 109.756 179.935 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.96 -39.6 92.69 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.925 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -63.44 -49.06 75.19 Favored 'General case' 0 C--N 1.362 1.146 0 CA-C-O 121.112 0.482 . . . . 0.0 110.945 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.3 -46.16 81.5 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-O 121.329 0.585 . . . . 0.0 110.087 -177.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -64.03 -50.44 68.46 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.636 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.91 -44.98 93.82 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.145 -0.808 . . . . 0.0 115.056 -175.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.627 ' HB3' HG13 ' A' ' 48' ' ' VAL . 57.6 m-85 -85.06 -33.53 22.45 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 119.753 1.776 . . . . 0.0 112.226 -175.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -81.7 -49.81 10.02 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 120.878 -1.139 . . . . 0.0 111.59 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -63.56 -44.78 93.15 Favored 'General case' 0 C--N 1.362 1.119 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -86.89 -21.28 26.43 Favored 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.841 -1.162 . . . . 0.0 110.55 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 64.28 34.95 10.28 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-O 122.488 1.137 . . . . 0.0 110.452 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -117.74 139.64 50.77 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.216 -1.357 . . . . 0.0 107.403 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 14.0 m -87.35 -16.81 33.94 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.71 124.38 27.16 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -92.87 156.28 40.79 Favored Pre-proline 0 C--N 1.348 0.532 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.9 142.26 87.65 Favored 'Trans proline' 0 CA--C 1.519 -0.266 0 C-N-CA 121.632 1.554 . . . . 0.0 113.048 177.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -38.16 95.27 Favored Glycine 0 C--N 1.358 1.754 0 O-C-N 121.844 -0.535 . . . . 0.0 112.535 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.66 72.56 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.659 1.23 . . . . 0.0 109.848 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -70.42 -33.29 71.17 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.58 -19.24 62.17 Favored 'General case' 0 C--N 1.363 1.184 0 O-C-N 121.702 -0.624 . . . . 0.0 110.98 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -64.78 -43.23 93.91 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-O 122.667 1.222 . . . . 0.0 107.995 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -65.0 -40.01 94.32 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 113.378 -1.737 . . . . 0.0 111.217 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.61 -41.79 68.46 Favored 'General case' 0 C--N 1.358 0.944 0 O-C-N 121.848 -0.533 . . . . 0.0 110.462 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.4 tp -68.3 -40.51 81.73 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 122.707 0.403 . . . . 0.0 110.491 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.884 0 N-CA-C 108.022 -2.031 . . . . 0.0 108.022 -179.079 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 . . . . . 0 C--O 1.234 0.239 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.5 pt -67.67 -22.02 27.97 Favored 'Isoleucine or valine' 0 C--N 1.366 1.292 0 O-C-N 121.735 -0.603 . . . . 0.0 112.349 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -72.43 -13.38 61.43 Favored 'General case' 0 C--N 1.362 1.125 0 O-C-N 121.271 -0.893 . . . . 0.0 110.978 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -93.72 -5.62 48.03 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.9 mt -104.7 -105.37 0.3 Allowed 'General case' 0 C--N 1.352 0.694 0 CA-C-O 122.024 0.916 . . . . 0.0 109.06 -179.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.5 p -89.8 151.48 45.56 Favored Pre-proline 0 C--O 1.236 0.346 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.34 125.65 19.07 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-N 119.792 0.962 . . . . 0.0 111.433 175.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.37 119.42 24.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 123.143 1.449 . . . . 0.0 112.106 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -83.88 161.8 54.47 Favored Pre-proline 0 N--CA 1.442 -0.837 0 CA-C-N 113.507 -1.679 . . . . 0.0 106.559 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -56.69 -24.72 56.3 Favored 'Trans proline' 0 N--CA 1.488 1.158 0 C-N-CA 122.381 2.054 . . . . 0.0 113.664 177.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -75.29 -52.23 11.35 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.65 -47.55 73.38 Favored 'General case' 0 C--N 1.368 1.377 0 C-N-CA 125.226 1.41 . . . . 0.0 110.767 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.05 -43.78 96.9 Favored 'Isoleucine or valine' 0 C--O 1.245 0.825 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.355 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.1 m -73.19 -36.74 66.61 Favored 'General case' 0 C--N 1.366 1.296 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.756 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.5 mt -71.45 -40.95 70.01 Favored 'General case' 0 C--N 1.365 1.276 0 O-C-N 121.649 -0.657 . . . . 0.0 110.389 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.579 ' CE1' HD11 ' A' ' 30' ' ' LEU . 70.6 t80 -63.79 -39.02 93.25 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -179.323 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.8 m -57.48 -55.22 46.79 Favored Pre-proline 0 CA--C 1.559 1.326 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo . . . . . 0 C--N 1.348 0.5 0 CA-C-N 121.597 1.606 . . . . 0.0 115.635 -178.878 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 . . . . . 0 N--CA 1.47 0.529 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.579 HD11 ' CE1' ' A' ' 17' ' ' TYR . 56.3 tp -60.53 -57.01 29.64 Favored Pre-proline 0 C--N 1.358 0.974 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -176.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -70.03 -23.08 29.96 Favored 'Trans proline' 0 CA--C 1.509 -0.729 0 CA-C-N 121.233 1.476 . . . . 0.0 114.67 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -71.25 -36.38 71.76 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.21 -17.89 60.26 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.456 -177.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.4 -19.36 63.81 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.02 -1.05 . . . . 0.0 109.902 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.4 m -84.6 -17.64 38.08 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.683 HD23 HD11 ' A' ' 42' ' ' ILE . 7.5 mp -88.03 -46.12 9.61 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -57.07 -23.9 50.02 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 124.416 1.086 . . . . 0.0 112.993 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -68.47 -10.52 55.96 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 121.275 -0.891 . . . . 0.0 111.632 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.25 11.11 11.04 Favored Glycine 0 C--N 1.375 2.714 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.7 m -70.49 -43.55 69.5 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.162 0.981 . . . . 0.0 109.69 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.5 t 68.91 175.79 0.28 Allowed 'General case' 0 C--N 1.375 1.716 0 CA-C-O 121.506 0.669 . . . . 0.0 110.465 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.683 HD11 HD23 ' A' ' 36' ' ' LEU . 2.9 mp -137.39 126.25 34.56 Favored 'Isoleucine or valine' 0 C--N 1.361 1.079 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -150.51 126.62 10.56 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 103.242 -2.873 . . . . 0.0 103.242 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.71 -169.87 41.55 Favored Glycine 0 CA--C 1.491 -1.437 0 N-CA-C 108.387 -1.885 . . . . 0.0 108.387 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.0 p -122.16 115.4 22.35 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.3 tpt180 -92.36 129.59 38.26 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.53 128.13 33.24 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-O 123.017 1.389 . . . . 0.0 110.713 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.528 HG13 ' HB3' ' A' ' 104' ' ' TYR . 83.6 t -110.23 116.21 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 N-CA-C 104.122 -2.547 . . . . 0.0 104.122 177.363 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -73.47 134.31 43.88 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.65 58.29 Favored Glycine 0 C--N 1.363 2.03 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.94 -105.28 0.62 Allowed Glycine 0 C--N 1.353 1.523 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.9 158.27 24.07 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.98 126.06 9.09 Favored 'Trans proline' 0 CA--C 1.513 -0.552 0 C-N-CA 121.439 1.426 . . . . 0.0 112.708 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.2 135.86 45.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 CA-C-O 122.173 0.987 . . . . 0.0 108.703 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.2 m -64.85 141.21 58.85 Favored 'General case' 0 C--N 1.364 1.231 0 CA-C-O 122.189 0.995 . . . . 0.0 111.683 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -141.1 144.76 35.08 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.8 t -129.36 130.16 67.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.53 134.55 34.03 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.6 t -131.61 149.47 52.49 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-O 122.582 1.182 . . . . 0.0 109.449 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.5 116.62 19.97 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -178.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.8 p -140.74 161.56 37.49 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.66 100.67 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.355 0 CA-C-O 122.397 1.094 . . . . 0.0 109.327 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -99.69 161.44 24.42 Favored Pre-proline 0 C--N 1.355 0.826 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -53.31 155.17 12.9 Favored 'Trans proline' 0 C--O 1.208 -1.009 0 C-N-CA 122.129 1.886 . . . . 0.0 115.566 179.097 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 41.5 tp -49.29 -50.65 63.21 Favored Pre-proline 0 CA--C 1.546 0.798 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -177.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -73.33 -8.49 21.95 Favored 'Trans proline' 0 C--N 1.352 0.759 0 CA-C-N 121.204 1.466 . . . . 0.0 112.394 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.38 25.01 10.75 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.096 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -75.33 65.97 1.71 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-O 122.224 1.011 . . . . 0.0 109.066 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 72.3 mtm -120.99 153.38 37.4 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 121.86 0.838 . . . . 0.0 109.525 -177.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 60.4 m -94.44 137.24 33.82 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -115.85 129.77 56.56 Favored 'General case' 0 C--N 1.362 1.124 0 CA-C-N 122.105 2.23 . . . . 0.0 109.208 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 10.6 t -125.53 139.12 53.88 Favored 'General case' 0 C--N 1.352 0.677 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -119.71 125.59 49.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 mt -126.64 135.18 50.85 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -103.62 139.95 38.23 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.32 106.97 17.76 Favored 'General case' 0 C--N 1.344 0.358 0 O-C-N 121.259 -0.9 . . . . 0.0 109.426 -178.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.2 t30 65.52 27.35 11.66 Favored 'General case' 0 C--N 1.374 1.656 0 C-N-CA 123.654 0.782 . . . . 0.0 109.967 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 65.55 23.79 11.78 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 123.637 0.775 . . . . 0.0 110.887 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -91.73 117.66 29.96 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.24 -19.52 66.01 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -86.21 -4.88 59.26 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 121.353 -0.842 . . . . 0.0 109.727 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.4 mt -125.82 94.54 4.15 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 -178.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 81.9 p -126.07 149.63 48.75 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.067 0.936 . . . . 0.0 109.321 -176.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -127.18 132.93 50.39 Favored 'General case' 0 CA--C 1.489 -1.39 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -121.02 110.4 16.22 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 104.028 -2.582 . . . . 0.0 104.028 178.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.3 mm -120.63 116.85 51.31 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.39 139.69 44.39 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.98 162.67 26.69 Favored Pre-proline 0 C--O 1.238 0.464 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 -178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -53.25 147.81 34.47 Favored 'Trans proline' 0 N--CA 1.483 0.871 0 C-N-CA 122.372 2.048 . . . . 0.0 112.0 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -18.76 52.05 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -174.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -89.13 -27.61 20.61 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.441 -0.787 . . . . 0.0 108.955 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.69 -31.65 15.03 Favored 'General case' 0 C--N 1.356 0.885 0 O-C-N 121.769 -0.582 . . . . 0.0 111.201 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -63.71 -39.83 95.28 Favored 'General case' 0 C--N 1.36 1.027 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.59 -28.3 69.84 Favored 'General case' 0 C--N 1.365 1.249 0 O-C-N 120.492 -1.38 . . . . 0.0 110.954 -177.105 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.12 -40.99 87.13 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.388 0.994 . . . . 0.0 109.249 177.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -67.83 -42.98 80.64 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 123.029 0.532 . . . . 0.0 109.831 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -43.5 98.69 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -175.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -42.28 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 121.493 -0.754 . . . . 0.0 109.368 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -63.01 -39.7 95.55 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.276 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.26 -44.82 94.06 Favored 'General case' 0 C--N 1.364 1.202 0 O-C-N 121.76 -0.587 . . . . 0.0 110.831 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 81.4 mt -69.19 -44.52 71.99 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-O 121.412 0.625 . . . . 0.0 109.551 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.0 ttp -62.55 -48.91 77.4 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.387 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.84 -47.22 90.67 Favored Glycine 0 C--N 1.353 1.524 0 O-C-N 121.14 -0.975 . . . . 0.0 113.913 -176.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.528 ' HB3' HG13 ' A' ' 48' ' ' VAL . 62.0 m-85 -87.85 -38.93 15.25 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-N 119.557 1.679 . . . . 0.0 113.622 -175.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -83.59 -51.64 7.13 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 120.302 -1.499 . . . . 0.0 111.794 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -64.6 -41.67 96.07 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.7 mmt -84.52 -21.16 30.65 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.967 -1.083 . . . . 0.0 110.423 -176.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 60.37 43.47 13.39 Favored 'General case' 0 C--N 1.369 1.436 0 CA-C-O 122.395 1.093 . . . . 0.0 110.753 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -134.96 144.8 47.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.922 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.68 -9.69 48.56 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -80.62 120.6 24.77 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -92.34 151.24 41.3 Favored Pre-proline 0 C--N 1.349 0.554 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -63.82 141.95 80.53 Favored 'Trans proline' 0 CA--C 1.517 -0.344 0 C-N-CA 121.721 1.614 . . . . 0.0 113.398 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.26 -37.64 94.9 Favored Glycine 0 C--N 1.357 1.743 0 O-C-N 121.862 -0.524 . . . . 0.0 112.449 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.47 -29.75 66.39 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 118.535 1.168 . . . . 0.0 109.887 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -36.45 64.96 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -69.71 -26.1 64.18 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.022 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.39 -48.54 80.76 Favored 'General case' 0 C--N 1.356 0.858 0 CA-C-O 122.133 0.968 . . . . 0.0 109.39 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -67.36 -42.18 83.9 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.287 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.5 -40.98 80.68 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.91 -0.494 . . . . 0.0 111.065 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 60.4 tp -67.08 -40.42 87.01 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.933 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 -179.983 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 . . . . . 0 CA--C 1.517 -0.312 0 CA-C-O 121.755 0.788 . . . . 0.0 108.969 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.3 pt -64.37 -21.29 28.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 123.546 0.738 . . . . 0.0 112.719 -178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -76.08 -8.6 57.37 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 121.131 -0.981 . . . . 0.0 111.165 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.39 -4.0 49.22 Favored 'General case' 0 C--N 1.357 0.915 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.6 mt -105.96 -112.93 0.26 Allowed 'General case' 0 C--N 1.349 0.553 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.707 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -90.01 158.3 44.57 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.707 ' HD2' HG22 ' A' ' 7' ' ' VAL . 82.3 Cg_exo -54.92 128.87 32.36 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 120.813 1.009 . . . . 0.0 112.288 176.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.93 117.59 16.94 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 123.161 1.457 . . . . 0.0 112.245 -175.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -85.68 161.45 50.71 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 113.409 -1.723 . . . . 0.0 106.986 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.7 -24.57 63.77 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.49 2.127 . . . . 0.0 113.432 177.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -74.07 -52.76 11.65 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.581 1.153 . . . . 0.0 107.961 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.61 -46.23 81.02 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.287 1.435 . . . . 0.0 110.764 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.6 t -61.0 -42.71 94.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -71.26 -36.01 71.59 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.303 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.78 -40.82 75.82 Favored 'General case' 0 C--N 1.369 1.433 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -75.33 -19.4 59.64 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.914 -0.491 . . . . 0.0 112.127 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.4 m -60.55 -54.99 49.38 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -177.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo . . . . . 0 CA--C 1.512 -0.59 0 CA-C-N 121.576 1.599 . . . . 0.0 114.224 -179.543 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 CA--C 1.535 0.382 0 CA-C-O 119.883 -0.103 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -66.39 -55.03 21.2 Favored Pre-proline 0 C--N 1.367 1.351 0 O-C-N 121.283 -0.885 . . . . 0.0 112.345 -178.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -64.95 -20.25 64.14 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 120.804 1.323 . . . . 0.0 114.713 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -73.19 -29.47 62.85 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.43 -17.93 57.67 Favored 'General case' 0 C--N 1.365 1.259 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.29 -36.09 80.82 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.3 t -63.69 -38.08 89.76 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.601 HD23 HD11 ' A' ' 42' ' ' ILE . 7.1 mp -68.67 -45.23 72.26 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -57.93 -37.71 74.6 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 124.65 1.18 . . . . 0.0 112.583 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.69 -10.23 25.59 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 121.305 -0.872 . . . . 0.0 112.529 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 125.39 2.49 7.56 Favored Glycine 0 C--N 1.374 2.663 0 CA-C-N 119.466 1.03 . . . . 0.0 111.889 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.0 t -68.24 -46.0 71.7 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-N 119.259 1.529 . . . . 0.0 109.828 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.31 -178.34 0.15 Allowed 'General case' 0 C--N 1.371 1.517 0 CA-C-O 121.301 0.572 . . . . 0.0 110.75 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.601 HD11 HD23 ' A' ' 36' ' ' LEU . 1.7 mp -140.6 125.92 19.6 Favored 'Isoleucine or valine' 0 C--N 1.363 1.191 0 CA-C-O 122.511 1.148 . . . . 0.0 108.453 179.025 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -154.03 125.71 7.63 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.41 -170.24 42.21 Favored Glycine 0 CA--C 1.492 -1.374 0 N-CA-C 108.456 -1.858 . . . . 0.0 108.456 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -119.13 112.66 19.8 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.3 tpt180 -95.66 132.49 40.79 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.04 129.8 37.4 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.959 1.362 . . . . 0.0 110.32 -178.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.1 t -114.0 119.34 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 104.177 -2.527 . . . . 0.0 104.177 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -72.61 135.95 45.62 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.419 0.628 . . . . 0.0 109.333 -178.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.41 -5.3 57.19 Favored Glycine 0 C--N 1.36 1.879 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.77 -103.5 0.38 Allowed Glycine 0 C--N 1.355 1.616 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.429 ' HB1' ' HD2' ' A' ' 53' ' ' PRO . . . -162.56 162.24 19.24 Favored Pre-proline 0 N--CA 1.447 -0.576 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -177.051 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.429 ' HD2' ' HB1' ' A' ' 52' ' ' ALA . 70.5 Cg_endo -72.62 127.18 12.15 Favored 'Trans proline' 0 CA--C 1.514 -0.481 0 C-N-CA 121.161 1.24 . . . . 0.0 113.527 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 pt -110.19 137.75 41.1 Favored 'Isoleucine or valine' 0 C--N 1.358 0.963 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.9 m -64.34 140.57 58.88 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.133 0.968 . . . . 0.0 112.002 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -140.71 143.59 35.11 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -129.75 131.43 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.475 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -138.05 130.25 28.89 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.8 p -127.74 154.84 44.89 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-O 122.383 1.087 . . . . 0.0 109.55 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.02 132.13 46.11 Favored 'General case' 0 C--N 1.355 0.833 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.9 m -155.13 148.57 25.11 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 103.396 -2.816 . . . . 0.0 103.396 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.8 m -71.26 100.01 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 122.754 1.264 . . . . 0.0 110.134 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.1 p -100.63 163.75 17.52 Favored Pre-proline 0 C--N 1.356 0.877 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -53.29 154.66 13.97 Favored 'Trans proline' 0 C--O 1.208 -1.015 0 C-N-CA 122.037 1.825 . . . . 0.0 115.286 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 54.8 tp -50.03 -50.62 67.93 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -177.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -73.04 -8.35 22.05 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.193 1.462 . . . . 0.0 112.339 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.22 24.38 11.2 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.249 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.23 70.41 2.86 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-O 122.241 1.02 . . . . 0.0 108.26 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.6 mtt -120.35 154.35 35.19 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 122.006 0.908 . . . . 0.0 110.068 -177.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 58.8 m -95.33 133.96 38.66 Favored 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.038 -2.208 . . . . 0.0 105.038 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -112.4 130.81 55.84 Favored 'General case' 0 C--N 1.359 1.016 0 CA-C-N 122.251 2.296 . . . . 0.0 109.318 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.3 t -126.08 135.82 52.18 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -115.4 124.3 50.85 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mt -126.01 125.32 42.47 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -101.78 137.59 39.89 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -86.11 113.81 22.47 Favored 'General case' 0 C--N 1.348 0.518 0 O-C-N 121.344 -0.847 . . . . 0.0 109.127 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 41.3 t30 63.89 26.29 14.22 Favored 'General case' 0 C--N 1.372 1.573 0 C-N-CA 123.475 0.71 . . . . 0.0 110.303 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 64.28 25.07 13.47 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 123.397 0.679 . . . . 0.0 111.003 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -94.8 122.52 37.51 Favored 'General case' 0 C--N 1.355 0.816 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.6 -35.65 78.46 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -70.47 -17.35 62.98 Favored 'General case' 0 C--N 1.358 0.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.523 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.9 mt -111.99 84.09 1.9 Allowed 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -122.65 131.73 53.94 Favored 'General case' 0 C--N 1.362 1.139 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -108.75 130.74 55.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -119.43 107.83 13.81 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -121.58 119.4 58.82 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.22 140.75 45.52 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -151.66 160.44 31.7 Favored Pre-proline 0 C--O 1.24 0.589 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.41 149.46 23.23 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 122.323 2.015 . . . . 0.0 111.709 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -61.84 -19.91 63.1 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 120.562 -1.336 . . . . 0.0 113.839 -174.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 49.9 p-80 -89.18 -24.52 22.14 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.34 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.01 -29.08 15.41 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.975 -0.453 . . . . 0.0 111.181 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -63.42 -38.09 89.79 Favored 'General case' 0 C--N 1.36 1.039 0 O-C-N 121.838 -0.538 . . . . 0.0 111.566 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.401 ' O ' HG13 ' A' ' 98' ' ' ILE . 9.2 mp -66.28 -32.58 74.07 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.652 -1.28 . . . . 0.0 109.622 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -59.21 -42.45 91.0 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 120.225 1.375 . . . . 0.0 108.974 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -63.04 -48.68 77.7 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.916 0.886 . . . . 0.0 109.994 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.26 -43.14 99.37 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.017 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 94' ' ' LEU . 0.5 OUTLIER -63.84 -44.54 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 O-C-N 121.244 -0.91 . . . . 0.0 109.753 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.75 -40.14 96.31 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.54 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttm -62.49 -50.74 70.22 Favored 'General case' 0 C--N 1.358 0.944 0 C-N-CA 122.366 0.266 . . . . 0.0 110.586 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.57 -44.17 96.98 Favored 'General case' 0 C--N 1.362 1.111 0 CA-C-O 121.546 0.689 . . . . 0.0 109.923 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 60.1 ttm -62.24 -49.02 77.41 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.479 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.41 -49.45 73.93 Favored Glycine 0 C--N 1.359 1.837 0 CA-C-O 118.952 -0.916 . . . . 0.0 115.285 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -85.89 -33.13 21.32 Favored 'General case' 0 C--N 1.363 1.19 0 CA-C-N 120.175 1.987 . . . . 0.0 113.107 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -80.85 -50.22 10.08 Favored 'General case' 0 C--N 1.354 0.786 0 O-C-N 120.449 -1.407 . . . . 0.0 111.392 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -63.82 -43.9 94.85 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -177.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.0 mtp -88.41 -17.17 31.04 Favored 'General case' 0 C--N 1.363 1.167 0 O-C-N 121.164 -0.96 . . . . 0.0 110.783 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 62.18 42.58 9.42 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-O 122.459 1.123 . . . . 0.0 110.74 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.17 144.34 45.79 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.3 -1.318 . . . . 0.0 107.895 179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 24.1 p -89.09 -14.21 36.81 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 121.112 0.482 . . . . 0.0 109.708 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -98.85 127.14 44.7 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -85.02 162.36 49.72 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -59.15 148.1 87.41 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 121.568 1.512 . . . . 0.0 113.05 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -37.45 92.13 Favored Glycine 0 C--N 1.359 1.833 0 O-C-N 121.735 -0.603 . . . . 0.0 112.869 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.45 -26.38 63.62 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 118.798 1.299 . . . . 0.0 109.955 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -75.51 -30.78 59.92 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -73.07 -17.21 61.44 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 121.42 -0.8 . . . . 0.0 110.541 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -67.61 -42.58 82.18 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-O 122.761 1.267 . . . . 0.0 107.634 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -64.03 -41.09 97.53 Favored 'General case' 0 C--N 1.357 0.903 0 CA-C-N 113.188 -1.824 . . . . 0.0 110.814 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.4 mp -71.25 -40.02 71.26 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 122.086 -0.383 . . . . 0.0 110.294 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.8 tp -67.9 -39.72 83.56 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 122.729 0.412 . . . . 0.0 109.951 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.955 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 179.577 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 . . . . . 0 C--O 1.233 0.202 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.9 pt -59.35 -19.71 16.79 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -79.39 -2.98 44.24 Favored 'General case' 0 C--N 1.365 1.264 0 CA-C-N 120.208 1.367 . . . . 0.0 110.571 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.27 -5.29 44.01 Favored 'General case' 0 C--N 1.357 0.916 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -107.1 -112.26 0.29 Allowed 'General case' 0 C--N 1.353 0.751 0 CA-C-O 121.98 0.895 . . . . 0.0 108.778 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.714 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.0 158.3 44.59 Favored Pre-proline 0 C--N 1.345 0.389 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.714 ' HD2' HG22 ' A' ' 7' ' ' VAL . 81.5 Cg_exo -55.12 128.21 29.58 Favored 'Trans proline' 0 N--CA 1.478 0.577 0 CA-C-N 119.842 0.979 . . . . 0.0 112.257 176.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.06 117.79 18.98 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 123.119 1.437 . . . . 0.0 112.326 -175.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -85.64 160.78 52.65 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 113.487 -1.688 . . . . 0.0 106.933 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.5 -25.28 65.84 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.441 2.094 . . . . 0.0 113.513 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -74.86 -50.95 15.23 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -46.06 80.09 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 125.201 1.401 . . . . 0.0 110.586 177.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.1 t -61.24 -43.52 96.63 Favored 'Isoleucine or valine' 0 C--N 1.348 0.539 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.866 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.7 m -73.01 -34.49 66.41 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.79 -176.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -71.98 -41.04 68.15 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 121.36 -0.838 . . . . 0.0 110.26 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -70.44 -34.71 72.78 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.2 m -49.65 -51.61 58.09 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -176.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo . . . . . 0 CA--C 1.516 -0.407 0 CA-C-N 121.788 1.674 . . . . 0.0 113.196 178.625 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 111.83 0.308 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.73 -56.66 27.29 Favored Pre-proline 0 C--N 1.364 1.207 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.71 -19.31 36.55 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 120.94 1.371 . . . . 0.0 114.667 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -70.59 -37.84 73.95 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.31 -27.48 60.73 Favored 'General case' 0 C--N 1.366 1.285 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.03 -38.18 85.46 Favored 'General case' 0 C--N 1.365 1.26 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.6 m -65.4 -39.81 92.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.125 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.927 HD13 HD11 ' A' ' 42' ' ' ILE . 72.4 mt -69.07 -39.46 79.08 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 121.486 -0.759 . . . . 0.0 110.136 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -53.76 -27.05 26.41 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 125.355 1.462 . . . . 0.0 112.823 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -64.34 -11.97 37.61 Favored 'General case' 0 C--N 1.363 1.192 0 O-C-N 121.133 -0.979 . . . . 0.0 112.505 -178.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.78 -0.33 10.98 Favored Glycine 0 C--N 1.371 2.499 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.6 m -69.7 -41.65 75.13 Favored 'General case' 0 C--N 1.358 0.936 0 CA-C-N 118.241 1.021 . . . . 0.0 109.647 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 66.18 -178.89 0.2 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.558 0.695 . . . . 0.0 110.852 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.927 HD11 HD13 ' A' ' 36' ' ' LEU . 2.6 mp -135.79 124.88 39.7 Favored 'Isoleucine or valine' 0 C--N 1.358 0.975 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -150.06 126.65 10.91 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 103.193 -2.892 . . . . 0.0 103.193 178.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 179.17 -171.02 42.93 Favored Glycine 0 CA--C 1.492 -1.371 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -121.3 115.32 22.76 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 tpt180 -91.91 130.31 37.7 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.82 116.38 20.78 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.829 1.299 . . . . 0.0 110.478 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.472 HG13 ' HB3' ' A' ' 104' ' ' TYR . 91.5 t -96.91 109.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 N-CA-C 104.426 -2.435 . . . . 0.0 104.426 176.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -70.49 131.08 43.49 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.78 58.35 Favored Glycine 0 C--N 1.359 1.814 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -134.77 -107.88 0.96 Allowed Glycine 0 C--N 1.356 1.654 0 N-CA-C 108.604 -1.799 . . . . 0.0 108.604 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.57 158.38 25.04 Favored Pre-proline 0 N--CA 1.445 -0.699 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -178.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.58 121.62 6.46 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.179 1.253 . . . . 0.0 112.963 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 3.6 pt -108.31 136.05 45.12 Favored 'Isoleucine or valine' 0 C--N 1.358 0.978 0 CA-C-O 122.217 1.008 . . . . 0.0 108.709 -178.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.0 m -65.28 141.45 58.6 Favored 'General case' 0 C--N 1.364 1.196 0 CA-C-O 122.186 0.993 . . . . 0.0 112.099 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -141.19 145.29 35.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -129.71 130.61 66.84 Favored 'Isoleucine or valine' 0 C--N 1.351 0.664 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.56 136.06 35.65 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.2 t -135.09 152.62 51.83 Favored 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.324 1.059 . . . . 0.0 109.562 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -123.72 114.76 20.37 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 66.4 p -140.3 161.15 38.36 Favored 'General case' 0 CA--C 1.497 -1.093 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -79.6 101.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 CA-C-O 122.377 1.084 . . . . 0.0 109.835 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -99.45 161.77 23.47 Favored Pre-proline 0 C--N 1.355 0.821 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_exo -53.64 156.47 11.57 Favored 'Trans proline' 0 C--O 1.207 -1.067 0 C-N-CA 122.145 1.896 . . . . 0.0 115.772 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.8 tp -49.24 -53.54 38.38 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -73.73 -6.42 18.62 Favored 'Trans proline' 0 C--N 1.353 0.799 0 CA-C-N 121.226 1.474 . . . . 0.0 112.636 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -116.97 25.15 10.71 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.71 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 68.96 2.4 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-O 122.195 0.997 . . . . 0.0 108.555 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 59.1 mtt -125.46 152.82 44.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.925 -177.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -90.82 134.05 34.74 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -110.55 131.09 55.35 Favored 'General case' 0 C--N 1.36 1.031 0 CA-C-N 122.063 2.211 . . . . 0.0 109.726 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.1 t -124.96 136.66 53.95 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.6 123.86 49.5 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.0 131.59 52.19 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -178.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -101.71 140.42 36.02 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.119 -1.438 . . . . 0.0 107.119 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -85.86 110.7 19.58 Favored 'General case' 0 C--N 1.348 0.52 0 O-C-N 121.356 -0.84 . . . . 0.0 109.077 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.41 26.43 15.76 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 123.702 0.801 . . . . 0.0 110.595 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 67.41 21.77 9.59 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 123.604 0.762 . . . . 0.0 110.959 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -91.28 114.94 27.61 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.49 -24.71 67.62 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -74.6 -15.85 60.82 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.372 -0.83 . . . . 0.0 109.337 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.2 mt -116.04 87.49 2.69 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.4 m -120.94 130.65 53.94 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -109.11 133.15 53.38 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.64 108.76 15.33 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 103.388 -2.819 . . . . 0.0 103.388 177.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 118.67 57.41 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 -176.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.99 141.79 46.31 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -151.04 159.06 34.34 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -52.26 149.62 21.91 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 C-N-CA 122.398 2.066 . . . . 0.0 111.973 176.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.22 -19.38 54.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.784 -1.198 . . . . 0.0 113.538 -174.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -89.8 -23.74 21.65 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.306 -0.871 . . . . 0.0 109.787 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -94.39 -30.45 14.48 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 123.054 0.541 . . . . 0.0 111.357 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.82 -39.27 93.78 Favored 'General case' 0 C--N 1.361 1.1 0 O-C-N 121.901 -0.499 . . . . 0.0 112.204 -176.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.92 -32.92 74.87 Favored 'General case' 0 C--O 1.205 -1.245 0 O-C-N 120.617 -1.302 . . . . 0.0 110.12 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.21 -41.69 89.17 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 119.952 1.251 . . . . 0.0 109.26 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -62.29 -48.21 80.88 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.81 0.844 . . . . 0.0 109.765 175.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.6 -42.57 99.06 Favored 'General case' 0 C--N 1.359 1.011 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.89 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -64.14 -43.22 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 O-C-N 121.337 -0.852 . . . . 0.0 109.519 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.03 -40.3 95.27 Favored 'General case' 0 C--N 1.363 1.163 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 45.5 ttm -62.85 -49.34 75.27 Favored 'General case' 0 C--N 1.356 0.89 0 CA-C-O 120.884 0.374 . . . . 0.0 111.01 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.23 -45.96 82.56 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 121.457 0.646 . . . . 0.0 109.978 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.4 ttm -62.65 -49.83 73.59 Favored 'General case' 0 C--O 1.217 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.553 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.67 -45.17 96.35 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 121.333 -0.855 . . . . 0.0 113.962 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.472 ' HB3' HG13 ' A' ' 48' ' ' VAL . 59.9 m-85 -86.82 -37.8 17.44 Favored 'General case' 0 C--N 1.358 0.947 0 CA-C-N 119.436 1.618 . . . . 0.0 113.008 -176.284 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -81.37 -50.7 9.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 120.507 -1.37 . . . . 0.0 111.877 -176.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -64.87 -42.58 94.72 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.4 mtp -84.01 -22.44 31.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.886 -1.134 . . . . 0.0 110.803 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 59.91 37.81 21.4 Favored 'General case' 0 C--N 1.369 1.425 0 CA-C-O 122.255 1.026 . . . . 0.0 110.921 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -127.83 145.88 50.79 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.591 -1.186 . . . . 0.0 108.405 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.1 t -89.06 -4.35 58.39 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.62 107.92 16.38 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -85.39 151.75 56.77 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.19 140.16 76.26 Favored 'Trans proline' 0 N--CA 1.472 0.256 0 C-N-CA 121.544 1.496 . . . . 0.0 113.37 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -37.08 93.54 Favored Glycine 0 C--N 1.357 1.725 0 O-C-N 121.88 -0.513 . . . . 0.0 112.417 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.73 -29.55 65.84 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.508 1.154 . . . . 0.0 109.69 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -72.78 -37.75 67.51 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -71.35 -24.75 62.16 Favored 'General case' 0 C--N 1.367 1.344 0 O-C-N 121.818 -0.551 . . . . 0.0 110.401 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.23 -46.5 90.17 Favored 'General case' 0 C--N 1.359 0.979 0 CA-C-O 121.953 0.882 . . . . 0.0 109.501 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -65.59 -39.58 91.73 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.748 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -43.67 77.64 Favored 'General case' 0 C--N 1.363 1.183 0 O-C-N 121.799 -0.563 . . . . 0.0 110.575 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.88 -41.25 83.08 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 122.766 0.426 . . . . 0.0 110.094 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.929 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 -179.736 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 . . . . . 0 CA--C 1.518 -0.283 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.2 tt -57.15 -24.68 21.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.352 0 C-N-CA 123.864 0.866 . . . . 0.0 112.648 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.29 -15.14 63.45 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 121.67 -0.643 . . . . 0.0 110.739 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -89.4 -5.68 57.23 Favored 'General case' 0 C--N 1.361 1.083 0 O-C-N 121.623 -0.673 . . . . 0.0 109.555 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -101.67 -104.14 0.26 Allowed 'General case' 0 C--N 1.35 0.609 0 CA-C-O 122.089 0.947 . . . . 0.0 109.108 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.591 HG22 ' HD2' ' A' ' 8' ' ' PRO . 3.3 p -89.93 153.99 47.44 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.591 ' HD2' HG22 ' A' ' 7' ' ' VAL . 71.5 Cg_exo -56.78 126.56 22.64 Favored 'Trans proline' 0 C--N 1.349 0.584 0 CA-C-N 119.635 0.905 . . . . 0.0 111.259 175.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.26 119.05 24.09 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.399 1.571 . . . . 0.0 112.563 -175.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -84.1 164.79 42.26 Favored Pre-proline 0 N--CA 1.439 -0.99 0 CA-C-N 112.954 -1.93 . . . . 0.0 106.036 175.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -55.52 -26.94 57.01 Favored 'Trans proline' 0 N--CA 1.486 1.066 0 C-N-CA 122.133 1.888 . . . . 0.0 113.031 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.65 -51.07 25.02 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 124.498 1.119 . . . . 0.0 108.954 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.36 81.58 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.031 1.332 . . . . 0.0 111.04 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 45.6 t -61.26 -44.03 97.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.049 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 67.5 m -72.42 -36.66 68.64 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.919 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.57 -41.04 69.53 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 121.522 -0.736 . . . . 0.0 110.68 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.429 ' CD1' HD21 ' A' ' 34' ' ' LEU . 72.9 t80 -66.23 -36.07 82.08 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.0 m -52.58 -54.76 39.18 Favored Pre-proline 0 N--CA 1.487 1.424 0 N-CA-C 114.714 1.375 . . . . 0.0 114.714 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 CA--C 1.516 -0.419 0 CA-C-N 121.486 1.567 . . . . 0.0 114.542 179.212 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 . . . . . 0 N--CA 1.468 0.436 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.43 -56.11 38.53 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.13 -18.12 24.05 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 CA-C-N 121.201 1.465 . . . . 0.0 114.508 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -70.17 -37.26 75.12 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.32 -24.22 57.38 Favored 'General case' 0 C--N 1.359 1.015 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.69 -178.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.429 HD21 ' CD1' ' A' ' 17' ' ' TYR . 94.0 mt -66.83 -38.58 86.7 Favored 'General case' 0 C--N 1.363 1.172 0 O-C-N 121.558 -0.714 . . . . 0.0 109.846 179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.0 t -65.77 -41.12 92.43 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.852 HD13 HD11 ' A' ' 42' ' ' ILE . 80.2 mt -64.59 -39.95 94.65 Favored 'General case' 0 C--N 1.36 1.054 0 O-C-N 121.499 -0.751 . . . . 0.0 109.446 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.62 -21.04 15.83 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.146 1.378 . . . . 0.0 112.647 178.133 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -70.13 -17.55 63.2 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.262 -0.899 . . . . 0.0 111.014 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.97 5.2 7.59 Favored Glycine 0 C--N 1.359 1.827 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.9 t -69.29 -44.09 72.51 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.272 1.036 . . . . 0.0 109.099 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 67.79 178.27 0.24 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.591 0.71 . . . . 0.0 110.54 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.852 HD11 HD13 ' A' ' 36' ' ' LEU . 2.6 mp -135.08 123.11 39.18 Favored 'Isoleucine or valine' 0 C--N 1.358 0.954 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -150.42 126.67 10.66 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 103.272 -2.862 . . . . 0.0 103.272 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.65 -168.91 40.2 Favored Glycine 0 CA--C 1.493 -1.335 0 N-CA-C 108.292 -1.923 . . . . 0.0 108.292 -178.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.6 p -121.45 114.51 21.37 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.52 134.27 35.13 Favored 'General case' 0 C--N 1.355 0.839 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 118.62 24.12 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.746 1.26 . . . . 0.0 110.326 -176.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.498 HG13 ' HB3' ' A' ' 104' ' ' TYR . 87.2 t -98.9 108.67 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 104.281 -2.489 . . . . 0.0 104.281 176.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -68.9 129.75 40.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 101.74 -8.59 56.42 Favored Glycine 0 C--N 1.361 1.918 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -133.91 -107.45 0.98 Allowed Glycine 0 C--N 1.355 1.601 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.59 158.6 25.28 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 124.38 8.3 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.178 1.252 . . . . 0.0 113.035 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.8 pt -111.12 139.72 33.75 Favored 'Isoleucine or valine' 0 C--N 1.356 0.866 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.4 p -65.9 144.9 56.51 Favored 'General case' 0 C--N 1.365 1.281 0 CA-C-O 121.746 0.784 . . . . 0.0 111.974 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -142.65 143.62 32.43 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.5 t -129.56 129.61 66.81 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.09 133.87 32.15 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -132.26 151.58 51.76 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 122.445 1.117 . . . . 0.0 108.754 -178.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -119.29 124.26 46.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 105.58 -2.008 . . . . 0.0 105.58 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.6 m -155.91 144.64 20.34 Favored 'General case' 0 CA--C 1.493 -1.212 0 N-CA-C 103.933 -2.618 . . . . 0.0 103.933 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 62' ' ' VAL . 0.7 OUTLIER -69.57 100.97 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-O 122.432 1.111 . . . . 0.0 110.86 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.76 156.95 34.58 Favored Pre-proline 0 C--N 1.352 0.674 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.69 152.33 1.67 Allowed 'Trans proline' 0 C--O 1.204 -1.216 0 C-N-CA 122.907 2.405 . . . . 0.0 117.029 -177.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.33 -50.9 73.49 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -176.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.07 -5.02 16.27 Favored 'Trans proline' 0 CA--C 1.511 -0.65 0 CA-C-N 121.036 1.406 . . . . 0.0 112.123 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.81 24.65 10.91 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -70.48 68.87 0.38 Allowed 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.557 0.694 . . . . 0.0 110.323 -178.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.1 mtt -124.39 153.93 41.15 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.826 0.822 . . . . 0.0 109.607 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.7 m -94.33 135.61 35.54 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 mtt85 -115.64 129.61 56.56 Favored 'General case' 0 C--N 1.361 1.079 0 CA-C-N 122.167 2.258 . . . . 0.0 109.64 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.4 t -123.33 141.23 52.2 Favored 'General case' 0 C--N 1.353 0.725 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -120.12 124.18 45.17 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -126.33 133.65 51.31 Favored 'General case' 0 C--N 1.355 0.838 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -103.88 139.56 38.89 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -86.24 112.52 21.45 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.662 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.66 25.31 15.05 Favored 'General case' 0 C--N 1.374 1.645 0 C-N-CA 123.717 0.807 . . . . 0.0 110.369 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 66.17 23.82 10.89 Favored 'General case' 0 C--N 1.371 1.509 0 C-N-CA 123.578 0.751 . . . . 0.0 110.693 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -93.44 118.17 30.99 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -18.3 65.23 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -85.59 -4.53 59.19 Favored 'General case' 0 C--N 1.357 0.934 0 O-C-N 121.211 -0.931 . . . . 0.0 109.58 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.06 95.33 4.27 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.3 p -126.05 149.6 48.75 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-O 122.115 0.959 . . . . 0.0 109.353 -176.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -126.42 132.24 51.55 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -120.82 108.29 13.76 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 103.194 -2.891 . . . . 0.0 103.194 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mm -120.51 118.93 58.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.097 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.32 142.21 45.77 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.12 159.75 33.12 Favored Pre-proline 0 C--O 1.239 0.541 0 N-CA-C 105.631 -1.988 . . . . 0.0 105.631 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -52.19 149.26 22.41 Favored 'Trans proline' 0 N--CA 1.484 0.953 0 C-N-CA 122.343 2.028 . . . . 0.0 111.502 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.21 -18.67 59.44 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.633 -1.292 . . . . 0.0 113.727 -174.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -89.7 -22.9 22.0 Favored 'General case' 0 C--N 1.355 0.822 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -94.61 -29.67 14.74 Favored 'General case' 0 C--N 1.357 0.933 0 O-C-N 121.784 -0.573 . . . . 0.0 111.134 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -64.61 -40.79 96.13 Favored 'General case' 0 C--N 1.361 1.082 0 O-C-N 121.944 -0.473 . . . . 0.0 111.857 -176.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.76 -32.83 74.6 Favored 'General case' 0 C--O 1.207 -1.183 0 O-C-N 120.461 -1.4 . . . . 0.0 110.101 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -59.52 -41.31 89.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.136 1.334 . . . . 0.0 108.893 177.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' TYR . . . . . 0.475 ' HE1' HD11 ' A' ' 120' ' ' LEU . 12.5 t80 -63.2 -48.18 79.44 Favored 'General case' 0 C--N 1.351 0.671 0 C-N-CA 123.622 0.769 . . . . 0.0 110.011 175.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -42.48 96.37 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.607 0.363 . . . . 0.0 111.595 -176.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.88 -44.7 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 121.485 -0.759 . . . . 0.0 109.62 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.63 -40.86 96.35 Favored 'General case' 0 C--N 1.363 1.193 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -63.03 -49.21 75.49 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.718 0.407 . . . . 0.0 110.913 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.01 -46.41 78.05 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-O 121.631 0.729 . . . . 0.0 110.247 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttm -62.45 -49.92 73.52 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.942 -178.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.2 -44.29 97.92 Favored Glycine 0 C--N 1.358 1.79 0 CA-C-O 119.371 -0.683 . . . . 0.0 114.11 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' TYR . . . . . 0.498 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.9 m-85 -85.49 -38.13 18.92 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.387 1.594 . . . . 0.0 112.34 -176.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -78.39 -50.09 12.36 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 120.647 -1.283 . . . . 0.0 111.975 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -66.24 -42.34 88.75 Favored 'General case' 0 C--N 1.357 0.896 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 86.8 mtp -86.33 -22.55 26.64 Favored 'General case' 0 C--N 1.367 1.337 0 O-C-N 120.743 -1.223 . . . . 0.0 110.703 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 62.61 32.51 16.31 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-O 122.067 0.937 . . . . 0.0 111.148 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -114.41 141.74 47.27 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.3 t -86.7 -9.05 56.81 Favored 'General case' 0 C--N 1.362 1.144 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -88.41 121.99 31.42 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -87.76 153.31 52.42 Favored Pre-proline 0 C--N 1.348 0.537 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -63.17 142.1 85.46 Favored 'Trans proline' 0 CA--C 1.519 -0.249 0 C-N-CA 121.611 1.541 . . . . 0.0 113.18 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.89 -38.28 95.74 Favored Glycine 0 C--N 1.357 1.701 0 O-C-N 121.82 -0.55 . . . . 0.0 112.585 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.65 -28.6 63.87 Favored 'General case' 0 C--N 1.36 1.043 0 CA-C-N 118.723 1.262 . . . . 0.0 109.652 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -72.65 -34.11 67.04 Favored 'General case' 0 C--N 1.356 0.881 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -73.56 -24.24 60.07 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 121.194 -0.941 . . . . 0.0 110.378 -179.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -61.98 -49.94 74.08 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-O 121.378 0.608 . . . . 0.0 111.314 -178.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.05 -23.96 63.18 Favored 'General case' 0 C--N 1.363 1.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.065 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.475 HD11 ' HE1' ' A' ' 96' ' ' TYR . 5.2 mp -84.04 -42.19 16.42 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.571 -0.706 . . . . 0.0 109.33 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.0 tp -68.21 -40.45 82.14 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.226 0 N-CA-C 110.236 -1.146 . . . . 0.0 110.236 179.2 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.8 mtm . . . . . 0 N--CA 1.502 2.146 0 CA-C-O 121.635 0.731 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -142.82 162.6 35.04 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-O 121.992 0.901 . . . . 0.0 109.666 -178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.76 -19.41 25.36 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.796 -178.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -72.95 -11.08 60.44 Favored 'General case' 0 C--N 1.362 1.143 0 O-C-N 121.139 -0.976 . . . . 0.0 110.671 -178.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -93.15 -6.41 47.95 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.5 mt -103.87 -114.58 0.23 Allowed 'General case' 0 C--N 1.353 0.722 0 CA-C-O 121.942 0.877 . . . . 0.0 109.102 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.723 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -89.52 158.05 46.24 Favored Pre-proline 0 C--N 1.345 0.39 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.723 ' HD2' HG22 ' A' ' 7' ' ' VAL . 85.3 Cg_exo -54.82 129.0 32.81 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 120.795 0.996 . . . . 0.0 112.181 176.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.92 117.0 14.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-O 123.415 1.579 . . . . 0.0 112.631 -175.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -85.8 160.91 51.92 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -60.42 -23.6 75.33 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 121.467 1.445 . . . . 0.0 113.01 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -73.12 -47.87 40.52 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-O 122.392 1.091 . . . . 0.0 108.601 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.35 93.32 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 125.07 1.348 . . . . 0.0 110.778 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.8 t -61.56 -44.36 98.5 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.962 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.2 p -73.21 -33.42 65.36 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 119.076 -1.05 . . . . 0.0 111.671 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.44 -38.93 71.29 Favored 'General case' 0 C--N 1.361 1.07 0 O-C-N 121.272 -0.893 . . . . 0.0 110.285 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.465 ' CD1' HD21 ' A' ' 34' ' ' LEU . 71.3 t80 -79.54 -13.64 59.4 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 121.921 -0.487 . . . . 0.0 111.742 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 17.5 m -59.19 -51.81 79.02 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 120.636 -1.29 . . . . 0.0 114.121 -177.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -66.95 124.7 12.59 Favored 'Trans proline' 0 C--N 1.349 0.572 0 CA-C-N 121.551 1.59 . . . . 0.0 114.683 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -104.89 101.86 11.42 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -83.0 128.79 34.8 Favored 'General case' 0 C--N 1.351 0.671 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.9 t -155.1 148.19 24.74 Favored 'General case' 0 C--N 1.353 0.755 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -109.76 -1.56 17.88 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -157.27 -73.51 0.09 Allowed 'General case' 0 C--N 1.363 1.172 0 O-C-N 121.258 -0.901 . . . . 0.0 109.183 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -137.0 -76.75 0.41 Allowed 'General case' 0 C--N 1.356 0.884 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -101.44 157.11 17.04 Favored 'General case' 0 C--N 1.354 0.771 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -140.87 128.17 21.05 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -68.6 -14.9 63.32 Favored 'General case' 0 C--N 1.357 0.923 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.52 -39.66 81.09 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 120.904 -1.122 . . . . 0.0 112.179 -177.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.9 tp -64.04 -54.68 38.19 Favored Pre-proline 0 C--N 1.361 1.104 0 O-C-N 121.326 -0.859 . . . . 0.0 112.82 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.97 -22.4 42.03 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.02 1.4 . . . . 0.0 114.506 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -70.86 -38.36 73.15 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.9 -33.49 68.37 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.465 HD21 ' CD1' ' A' ' 17' ' ' TYR . 80.1 mt -63.46 -39.47 94.55 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 121.644 -0.66 . . . . 0.0 109.529 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.7 m -64.07 -40.31 95.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.469 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.81 HD13 HD11 ' A' ' 42' ' ' ILE . 59.2 mt -69.04 -39.73 79.02 Favored 'General case' 0 C--N 1.361 1.077 0 CA-C-O 121.094 0.474 . . . . 0.0 110.016 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -51.78 -23.7 4.99 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 125.651 1.58 . . . . 0.0 113.408 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -66.91 -19.82 65.8 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.509 -0.744 . . . . 0.0 111.497 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 130.03 -0.69 5.74 Favored Glycine 0 C--N 1.359 1.844 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.3 m -66.64 -41.83 87.67 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 118.28 1.04 . . . . 0.0 109.515 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 m 65.72 177.91 0.21 Allowed 'General case' 0 C--N 1.375 1.678 0 CA-C-O 121.676 0.751 . . . . 0.0 110.848 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.81 HD11 HD13 ' A' ' 36' ' ' LEU . 3.0 mp -132.59 126.8 55.45 Favored 'Isoleucine or valine' 0 C--N 1.359 0.98 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -154.99 133.65 12.03 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.05 -170.22 43.33 Favored Glycine 0 CA--C 1.491 -1.425 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 50.3 m -120.69 114.45 21.69 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -91.53 129.07 37.57 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.21 123.15 27.68 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.915 1.341 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.563 HG13 ' HB3' ' A' ' 104' ' ' TYR . 92.7 t -107.2 116.47 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.24 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 177.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -72.33 136.69 46.27 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.589 0.709 . . . . 0.0 109.39 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.28 -8.1 62.4 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 110.277 -1.129 . . . . 0.0 110.277 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.8 -104.15 0.61 Allowed Glycine 0 C--N 1.354 1.561 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.14 159.16 21.37 Favored Pre-proline 0 N--CA 1.448 -0.562 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.7 124.01 7.88 Favored 'Trans proline' 0 CA--C 1.515 -0.466 0 C-N-CA 121.341 1.361 . . . . 0.0 112.818 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.52 136.15 45.07 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 CA-C-O 122.244 1.021 . . . . 0.0 108.927 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 57.8 m -65.02 141.47 58.75 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.165 0.983 . . . . 0.0 112.276 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -141.06 144.42 34.94 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 54.8 t -130.38 131.79 65.17 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.54 134.3 33.72 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.7 m -131.16 132.21 44.59 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 122.19 0.995 . . . . 0.0 109.099 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -113.97 132.15 56.07 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.8 t -164.17 179.19 7.05 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.91 99.93 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.297 0 CA-C-O 122.628 1.204 . . . . 0.0 109.383 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.8 t -100.59 144.53 28.67 Favored Pre-proline 0 C--N 1.354 0.779 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -49.37 149.71 8.98 Favored 'Trans proline' 0 CA--C 1.501 -1.136 0 C-N-CA 122.526 2.15 . . . . 0.0 116.334 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.0 tp -46.72 -51.06 40.12 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.27 -6.35 17.11 Favored 'Trans proline' 0 C--N 1.353 0.778 0 CA-C-N 121.44 1.55 . . . . 0.0 112.425 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.25 27.23 9.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.898 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -68.54 64.8 0.11 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-O 121.252 0.549 . . . . 0.0 110.582 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.2 mtt -125.02 152.87 43.68 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.784 0.802 . . . . 0.0 108.966 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.7 m -95.92 132.86 40.76 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -109.99 131.91 54.63 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 122.194 2.27 . . . . 0.0 109.824 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.5 t -125.08 137.45 54.2 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -115.18 125.33 53.28 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.3 129.33 47.49 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.09 138.87 39.35 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -86.02 112.3 21.1 Favored 'General case' 0 C--N 1.349 0.575 0 O-C-N 121.266 -0.896 . . . . 0.0 109.205 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.1 t30 63.83 26.69 14.41 Favored 'General case' 0 C--N 1.372 1.569 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.131 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 64.93 24.19 12.66 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 123.529 0.732 . . . . 0.0 110.895 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.63 116.15 28.75 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.59 -25.38 68.05 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -75.79 -14.15 60.3 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 121.195 -0.941 . . . . 0.0 109.613 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.9 mt -116.94 85.6 2.35 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.3 m -120.36 130.19 54.29 Favored 'General case' 0 C--N 1.361 1.106 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -109.17 132.3 54.24 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -118.5 107.88 14.32 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.8 mm -118.87 118.96 59.53 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.191 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.97 141.97 46.36 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -150.08 160.14 34.05 Favored Pre-proline 0 CA--C 1.51 -0.564 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.31 150.38 15.01 Favored 'Trans proline' 0 N--CA 1.485 0.979 0 C-N-CA 122.16 1.907 . . . . 0.0 111.716 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -62.7 -19.18 63.63 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 120.323 -1.486 . . . . 0.0 113.728 -174.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -89.1 -24.58 22.23 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.45 -29.34 16.31 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 123.124 0.57 . . . . 0.0 111.137 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.68 -39.82 94.32 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 122.035 -0.416 . . . . 0.0 111.905 -176.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -63.97 -37.53 87.74 Favored 'General case' 0 C--N 1.359 0.995 0 O-C-N 120.447 -1.408 . . . . 0.0 110.269 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -58.16 -41.36 83.63 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 120.271 1.396 . . . . 0.0 109.593 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -61.19 -48.3 82.18 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 109.952 175.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.92 -41.54 91.97 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.762 -176.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.72 -45.45 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 121.429 -0.794 . . . . 0.0 109.59 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.82 -40.8 98.49 Favored 'General case' 0 C--N 1.36 1.049 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.125 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -62.65 -47.65 82.79 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 122.635 0.374 . . . . 0.0 110.728 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.12 -44.94 82.85 Favored 'General case' 0 C--N 1.36 1.058 0 CA-C-O 121.446 0.641 . . . . 0.0 109.864 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.5 ttt -61.81 -48.73 79.3 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.482 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.14 -46.66 92.75 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 121.282 -0.886 . . . . 0.0 113.617 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.563 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.2 m-85 -88.15 -39.22 14.71 Favored 'General case' 0 C--N 1.36 1.053 0 CA-C-N 119.328 1.564 . . . . 0.0 113.793 -176.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -83.86 -53.38 5.64 Favored 'General case' 0 C--N 1.354 0.787 0 O-C-N 120.29 -1.507 . . . . 0.0 111.983 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -62.84 -40.78 98.49 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.3 mmt -85.41 -20.69 29.45 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 121.017 -1.052 . . . . 0.0 110.833 -176.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 60.03 53.78 4.46 Favored 'General case' 0 C--N 1.366 1.316 0 CA-C-O 122.387 1.089 . . . . 0.0 111.835 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.73 155.36 38.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.5 m -109.85 55.53 0.64 Allowed 'General case' 0 C--N 1.364 1.237 0 CA-C-O 122.127 0.965 . . . . 0.0 108.677 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -132.49 115.34 15.38 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.449 -1.685 . . . . 0.0 106.449 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -85.4 144.72 40.98 Favored Pre-proline 0 C--N 1.35 0.622 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -63.77 143.79 87.24 Favored 'Trans proline' 0 CA--C 1.518 -0.28 0 C-N-CA 121.48 1.453 . . . . 0.0 112.793 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.89 96.54 Favored Glycine 0 C--N 1.355 1.627 0 O-C-N 121.743 -0.598 . . . . 0.0 112.906 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -73.17 -28.32 62.15 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.903 1.351 . . . . 0.0 109.681 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -73.34 -36.53 66.18 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -70.6 -23.14 62.51 Favored 'General case' 0 C--N 1.365 1.279 0 O-C-N 121.909 -0.494 . . . . 0.0 110.369 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -61.83 -47.0 87.03 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-O 122.189 0.995 . . . . 0.0 109.345 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -66.31 -39.32 89.21 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.649 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.07 -43.4 78.66 Favored 'General case' 0 C--N 1.364 1.203 0 O-C-N 121.826 -0.546 . . . . 0.0 110.332 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.58 -40.87 89.16 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 93.17 41.4 4.58 Favored Glycine 0 C--N 1.362 1.976 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -100.67 115.79 31.06 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 -179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -86.61 95.83 9.9 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.268 2.042 0 CA-C-O 118.084 -0.96 . . . . 0.0 109.57 179.229 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ttt . . . . . 0 N--CA 1.504 2.266 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.433 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 57.1 ttp180 -109.0 133.67 52.68 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.2 pt -61.73 -20.66 23.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.272 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.433 ' H ' ' HG2' ' A' ' 2' ' ' ARG . 98.4 m-20 -74.08 -9.91 59.09 Favored 'General case' 0 C--N 1.362 1.13 0 O-C-N 121.373 -0.829 . . . . 0.0 110.248 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -90.29 -6.9 54.61 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 80.7 mt -106.84 -108.67 0.31 Allowed 'General case' 0 C--N 1.352 0.701 0 CA-C-O 122.099 0.952 . . . . 0.0 109.253 -178.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.4 p -89.62 152.49 47.13 Favored Pre-proline 0 C--O 1.236 0.389 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -57.68 125.99 20.44 Favored 'Trans proline' 0 C--N 1.348 0.539 0 CA-C-N 119.737 0.942 . . . . 0.0 111.259 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.89 120.09 23.0 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 123.251 1.501 . . . . 0.0 112.761 -175.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -83.49 162.32 53.84 Favored Pre-proline 0 N--CA 1.443 -0.787 0 CA-C-N 113.388 -1.733 . . . . 0.0 106.403 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -55.79 -24.59 47.49 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.488 2.125 . . . . 0.0 113.692 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.6 mtt180 -75.13 -52.25 11.43 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 124.513 1.125 . . . . 0.0 108.289 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.8 77.95 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.23 1.412 . . . . 0.0 110.802 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -60.96 -44.05 97.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.565 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.17 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.3 m -72.69 -37.46 67.84 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.79 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.71 -40.64 76.17 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 121.583 -0.698 . . . . 0.0 110.297 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -71.23 -20.44 62.25 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.1 m -58.95 -54.84 52.47 Favored Pre-proline 0 N--CA 1.486 1.349 0 O-C-N 120.976 -1.078 . . . . 0.0 113.422 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.8 150.08 38.67 Favored 'Trans proline' 0 C--N 1.348 0.514 0 CA-C-N 121.323 1.508 . . . . 0.0 113.958 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -128.05 -173.24 2.88 Favored 'General case' 0 C--N 1.354 0.788 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -76.59 133.61 39.61 Favored 'General case' 0 C--N 1.357 0.906 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 49.4 m -79.18 59.21 2.71 Favored 'General case' 0 C--N 1.364 1.226 0 O-C-N 121.833 -0.542 . . . . 0.0 110.503 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -128.67 -29.25 2.4 Favored 'General case' 0 C--N 1.349 0.552 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.44 170.94 19.06 Favored 'General case' 0 C--N 1.358 0.963 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -64.05 -38.57 91.57 Favored 'General case' 0 C--N 1.365 1.279 0 N-CA-C 109.803 -0.444 . . . . 0.0 109.803 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -134.4 132.59 39.58 Favored 'General case' 0 C--N 1.354 0.765 0 N-CA-C 104.742 -2.318 . . . . 0.0 104.742 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.25 154.73 42.95 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 121.778 0.799 . . . . 0.0 109.918 -177.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 90.4 mmt-85 -66.48 -22.53 66.19 Favored 'General case' 0 C--N 1.361 1.071 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.026 -179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -70.44 -27.55 64.34 Favored 'General case' 0 C--N 1.347 0.471 0 O-C-N 121.788 -0.57 . . . . 0.0 111.286 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.468 ' HB3' ' HD3' ' A' ' 31' ' ' PRO . 46.0 tp -64.96 -56.06 23.34 Favored Pre-proline 0 C--N 1.367 1.331 0 O-C-N 121.367 -0.833 . . . . 0.0 112.431 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 30' ' ' LEU . 37.7 Cg_exo -61.52 -23.08 76.05 Favored 'Trans proline' 0 C--N 1.358 1.047 0 CA-C-N 121.185 1.459 . . . . 0.0 115.09 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -68.16 -36.26 79.37 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.96 -19.13 60.24 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 121.955 -0.466 . . . . 0.0 109.952 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.8 mt -70.77 -20.12 62.64 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 121.378 -0.827 . . . . 0.0 109.821 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.6 m -84.68 -18.25 35.92 Favored 'General case' 0 C--N 1.351 0.657 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.717 HD13 HD11 ' A' ' 42' ' ' ILE . 70.0 mt -88.38 -43.79 11.24 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -55.61 -25.68 39.95 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 124.466 1.106 . . . . 0.0 113.07 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.21 -10.5 54.9 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 121.444 -0.785 . . . . 0.0 111.892 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.58 5.64 11.03 Favored Glycine 0 C--N 1.375 2.703 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 m -71.17 -43.03 68.29 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 118.259 1.029 . . . . 0.0 109.293 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.6 t 67.33 179.77 0.22 Allowed 'General case' 0 C--N 1.374 1.656 0 CA-C-O 121.592 0.71 . . . . 0.0 110.712 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.717 HD11 HD13 ' A' ' 36' ' ' LEU . 3.0 mp -136.09 125.16 38.63 Favored 'Isoleucine or valine' 0 C--N 1.358 0.972 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -150.98 127.39 10.69 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 103.285 -2.857 . . . . 0.0 103.285 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -179.83 -172.36 43.77 Favored Glycine 0 CA--C 1.493 -1.313 0 N-CA-C 108.539 -1.824 . . . . 0.0 108.539 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 51.1 m -121.09 115.72 23.63 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -95.72 132.47 40.88 Favored 'General case' 0 C--N 1.355 0.812 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.25 22.52 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-O 122.663 1.22 . . . . 0.0 110.146 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.506 HG13 ' HB3' ' A' ' 104' ' ' TYR . 91.6 t -101.21 115.56 43.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 N-CA-C 104.334 -2.469 . . . . 0.0 104.334 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -70.61 136.56 49.26 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.52 -6.1 57.36 Favored Glycine 0 C--N 1.359 1.839 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.1 -103.38 0.4 Allowed Glycine 0 C--N 1.355 1.604 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.12 160.87 24.46 Favored Pre-proline 0 N--CA 1.448 -0.563 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -177.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.9 126.17 10.46 Favored 'Trans proline' 0 CA--C 1.513 -0.528 0 C-N-CA 121.353 1.369 . . . . 0.0 113.403 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 2.7 pt -109.47 137.42 41.69 Favored 'Isoleucine or valine' 0 C--N 1.357 0.913 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 59.7 m -65.84 143.93 57.16 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-O 122.078 0.942 . . . . 0.0 111.466 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -140.92 144.42 35.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.9 t -129.2 131.96 67.32 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 N-CA-C 106.486 -1.672 . . . . 0.0 106.486 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.64 130.15 29.63 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.5 m -128.12 131.09 49.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.505 1.145 . . . . 0.0 109.554 -177.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -110.95 124.36 51.98 Favored 'General case' 0 C--N 1.354 0.791 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.5 m -152.01 147.56 26.66 Favored 'General case' 0 CA--C 1.488 -1.413 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -71.19 100.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-O 122.694 1.235 . . . . 0.0 110.765 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.7 p -99.87 161.86 22.97 Favored Pre-proline 0 C--N 1.354 0.767 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 178.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -51.29 153.78 9.22 Favored 'Trans proline' 0 C--O 1.206 -1.122 0 C-N-CA 122.151 1.9 . . . . 0.0 115.721 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.6 tp -46.45 -54.31 19.2 Favored Pre-proline 0 CA--C 1.549 0.918 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -74.1 -6.9 19.18 Favored 'Trans proline' 0 C--N 1.353 0.77 0 CA-C-N 121.321 1.507 . . . . 0.0 112.946 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.35 24.97 10.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.333 -0.849 . . . . 0.0 108.962 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -73.63 68.91 1.24 Allowed 'General case' 0 C--N 1.379 1.877 0 CA-C-O 121.927 0.87 . . . . 0.0 109.471 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.7 mtt -120.5 154.11 35.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.916 0.865 . . . . 0.0 109.896 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 79.3 m -96.33 137.03 36.0 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 -112.69 130.16 56.15 Favored 'General case' 0 C--N 1.36 1.057 0 CA-C-N 122.261 2.301 . . . . 0.0 109.385 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.5 t -123.36 138.77 54.53 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -120.07 125.25 47.84 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.6 mt -128.43 140.24 51.94 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.5 pm0 -127.97 142.9 51.11 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 178.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -91.1 124.2 35.14 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.534 -0.729 . . . . 0.0 110.793 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 60.87 24.15 14.15 Favored 'General case' 0 C--N 1.374 1.649 0 C-N-CA 124.176 0.99 . . . . 0.0 110.995 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 63.38 26.89 15.15 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 123.344 0.658 . . . . 0.0 110.534 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -93.11 122.36 35.4 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.76 -16.16 63.72 Favored 'General case' 0 C--N 1.352 0.698 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -88.0 -2.88 58.88 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 120.863 -1.148 . . . . 0.0 109.466 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.2 mt -124.05 94.87 4.35 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 -178.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 74.2 p -128.67 151.05 49.96 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-O 121.755 0.788 . . . . 0.0 109.174 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -137.4 132.52 33.6 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.83 111.62 18.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 103.489 -2.782 . . . . 0.0 103.489 177.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.8 mm -119.3 117.82 55.38 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.985 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.2 139.63 44.67 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -152.92 162.64 25.87 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -52.55 149.27 24.56 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 C-N-CA 122.389 2.059 . . . . 0.0 112.298 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -59.52 -19.82 50.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.964 -1.085 . . . . 0.0 113.814 -174.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -88.77 -45.58 9.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -71.53 -35.45 70.69 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.197 0.599 . . . . 0.0 111.068 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -62.72 -38.99 92.67 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 123.033 0.533 . . . . 0.0 111.673 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.03 -26.38 67.49 Favored 'General case' 0 C--O 1.207 -1.18 0 O-C-N 120.286 -1.509 . . . . 0.0 110.619 -177.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.99 -40.77 97.14 Favored 'General case' 0 C--N 1.374 1.647 0 CA-C-N 119.993 1.27 . . . . 0.0 108.585 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -61.99 -47.11 86.29 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 123.935 0.894 . . . . 0.0 109.507 175.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.1 tp -60.89 -42.69 98.48 Favored 'General case' 0 C--N 1.357 0.929 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.739 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -45.95 97.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.416 -0.803 . . . . 0.0 109.653 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.71 -41.25 99.05 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.481 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 66.4 ttp -63.07 -48.7 77.5 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 122.686 0.394 . . . . 0.0 111.092 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -66.35 -45.95 78.44 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-O 121.604 0.716 . . . . 0.0 109.9 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.85 -50.33 71.35 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.157 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.12 -45.1 97.23 Favored Glycine 0 C--N 1.359 1.83 0 CA-C-O 119.123 -0.821 . . . . 0.0 115.112 -174.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.506 ' HB3' HG13 ' A' ' 48' ' ' VAL . 76.4 m-85 -84.57 -33.59 23.38 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-N 119.827 1.813 . . . . 0.0 111.867 -176.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -82.13 -49.52 10.07 Favored 'General case' 0 C--N 1.349 0.574 0 O-C-N 120.851 -1.156 . . . . 0.0 111.672 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -64.54 -43.82 92.75 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -85.22 -22.08 28.83 Favored 'General case' 0 C--N 1.367 1.33 0 O-C-N 120.684 -1.26 . . . . 0.0 110.704 -176.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 61.46 40.84 13.41 Favored 'General case' 0 C--N 1.367 1.364 0 CA-C-O 122.434 1.112 . . . . 0.0 110.461 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -125.46 147.57 49.16 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.386 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.4 p -91.06 -10.86 40.58 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -81.99 118.75 23.23 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -85.48 151.39 55.98 Favored Pre-proline 0 C--N 1.347 0.491 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -62.53 141.12 85.2 Favored 'Trans proline' 0 N--CA 1.473 0.322 0 C-N-CA 121.508 1.472 . . . . 0.0 113.078 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.6 -38.94 96.68 Favored Glycine 0 C--N 1.356 1.667 0 O-C-N 121.934 -0.478 . . . . 0.0 112.827 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.24 -29.45 63.95 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 118.811 1.305 . . . . 0.0 109.654 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.93 -35.32 67.0 Favored 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -70.75 -22.46 62.4 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 121.795 -0.566 . . . . 0.0 110.177 -178.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -62.74 -45.77 91.16 Favored 'General case' 0 C--N 1.364 1.223 0 CA-C-O 122.136 0.969 . . . . 0.0 108.964 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.89 -40.21 96.85 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.809 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.62 -43.45 69.24 Favored 'General case' 0 C--N 1.358 0.978 0 O-C-N 122.065 -0.397 . . . . 0.0 110.385 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 55.6 tp -66.93 -40.67 87.66 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.834 0.454 . . . . 0.0 110.272 -179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.4 26.87 29.2 Favored Glycine 0 C--N 1.364 2.121 0 N-CA-C 110.039 -1.224 . . . . 0.0 110.039 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -97.81 116.37 29.88 Favored 'General case' 0 C--N 1.35 0.623 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -82.9 96.17 8.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 -179.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 C--O 1.271 2.192 0 CA-C-O 118.101 -0.952 . . . . 0.0 109.057 178.628 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 tpp . . . . . 0 N--CA 1.504 2.247 0 CA-C-O 121.339 0.59 . . . . 0.0 111.815 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.7 ptt-85 -149.39 163.61 37.26 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.9 pt -63.49 -21.59 28.83 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -79.44 -8.92 59.46 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 121.083 -1.011 . . . . 0.0 111.041 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -101.79 -1.62 31.93 Favored 'General case' 0 C--N 1.36 1.029 0 O-C-N 121.599 -0.688 . . . . 0.0 109.499 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.9 mt -102.77 -120.45 0.19 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-O 121.966 0.888 . . . . 0.0 108.785 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.719 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -89.23 158.43 46.49 Favored Pre-proline 0 C--N 1.347 0.459 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 179.551 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.719 ' HD2' HG22 ' A' ' 7' ' ' VAL . 88.6 Cg_exo -53.99 126.59 22.52 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 120.821 1.014 . . . . 0.0 112.617 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.07 118.8 18.42 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 123.2 1.476 . . . . 0.0 112.067 -176.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -84.24 160.74 56.59 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-N 113.372 -1.74 . . . . 0.0 106.909 176.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.08 -19.03 61.46 Favored 'Trans proline' 0 N--CA 1.486 1.072 0 C-N-CA 122.039 1.826 . . . . 0.0 113.416 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -76.5 -53.07 8.6 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.19 -46.59 79.33 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 125.436 1.495 . . . . 0.0 110.823 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -60.96 -42.67 93.77 Favored 'Isoleucine or valine' 0 C--N 1.349 0.576 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.9 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.3 m -71.52 -36.56 71.07 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.385 -176.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.2 mt -70.51 -40.67 73.37 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 121.656 -0.652 . . . . 0.0 110.323 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -72.42 -22.14 61.15 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -59.34 -54.58 54.78 Favored Pre-proline 0 N--CA 1.485 1.325 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.55 155.23 40.4 Favored 'Trans proline' 0 C--N 1.349 0.56 0 CA-C-N 121.308 1.503 . . . . 0.0 114.266 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.4 p90 -155.28 158.87 39.47 Favored 'General case' 0 C--N 1.35 0.626 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -91.95 67.78 5.24 Favored 'General case' 0 C--N 1.357 0.926 0 CA-C-O 121.327 0.584 . . . . 0.0 109.748 -178.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.7 t -162.5 152.48 16.3 Favored 'General case' 0 C--N 1.351 0.651 0 N-CA-C 106.668 -1.605 . . . . 0.0 106.668 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -79.37 -19.84 49.2 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -157.92 154.34 27.71 Favored 'General case' 0 C--N 1.356 0.88 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.6 t30 67.6 -121.23 0.22 Allowed 'General case' 0 C--N 1.366 1.306 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 41.8 ptt180 -160.34 163.41 33.29 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -106.87 171.18 7.51 Favored 'General case' 0 C--N 1.356 0.864 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -60.32 -27.69 67.53 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 123.726 0.81 . . . . 0.0 112.217 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -69.07 -27.7 65.86 Favored 'General case' 0 C--N 1.349 0.582 0 O-C-N 121.807 -0.558 . . . . 0.0 111.783 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.0 tp -67.14 -56.02 14.33 Favored Pre-proline 0 C--N 1.365 1.245 0 O-C-N 121.238 -0.914 . . . . 0.0 112.9 -177.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.99 -18.31 31.33 Favored 'Trans proline' 0 C--N 1.356 0.974 0 CA-C-N 121.112 1.433 . . . . 0.0 114.046 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -69.41 -36.1 76.41 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.56 -18.48 59.74 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.932 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.91 -36.18 82.67 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 121.412 -0.805 . . . . 0.0 108.905 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -64.27 -38.25 90.36 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.001 -0.437 . . . . 0.0 110.044 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.573 ' CD2' HD11 ' A' ' 42' ' ' ILE . 7.5 mp -68.31 -43.98 76.42 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -55.01 -28.42 51.93 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 124.763 1.225 . . . . 0.0 112.602 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -65.09 -19.94 66.23 Favored 'General case' 0 C--N 1.361 1.099 0 O-C-N 121.257 -0.902 . . . . 0.0 111.064 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.23 11.21 7.58 Favored Glycine 0 C--N 1.36 1.915 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.3 m -65.73 -43.84 87.81 Favored 'General case' 0 C--N 1.361 1.088 0 CA-C-N 117.552 0.676 . . . . 0.0 109.437 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.9 m 65.28 173.94 0.21 Allowed 'General case' 0 C--N 1.375 1.675 0 CA-C-O 121.969 0.89 . . . . 0.0 111.356 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.573 HD11 ' CD2' ' A' ' 36' ' ' LEU . 2.7 mp -136.24 127.06 42.37 Favored 'Isoleucine or valine' 0 C--N 1.36 1.024 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -151.47 126.03 9.52 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 103.187 -2.894 . . . . 0.0 103.187 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.75 -169.19 41.08 Favored Glycine 0 CA--C 1.492 -1.367 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 p -121.54 115.9 23.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -92.56 130.45 38.2 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.85 118.49 22.41 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 122.874 1.321 . . . . 0.0 110.746 -176.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.443 HG13 ' HB3' ' A' ' 104' ' ' TYR . 93.4 t -99.01 109.55 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 176.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -70.31 132.5 45.78 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.59 -8.69 58.48 Favored Glycine 0 C--N 1.358 1.787 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.14 -107.12 0.9 Allowed Glycine 0 C--N 1.355 1.628 0 N-CA-C 108.668 -1.773 . . . . 0.0 108.668 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.5 157.98 24.69 Favored Pre-proline 0 N--CA 1.445 -0.697 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.78 124.95 9.12 Favored 'Trans proline' 0 CA--C 1.514 -0.508 0 C-N-CA 121.156 1.237 . . . . 0.0 112.891 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 pt -109.34 136.8 44.13 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 CA-C-O 122.055 0.931 . . . . 0.0 108.866 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.8 m -65.62 141.34 58.44 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-O 122.127 0.965 . . . . 0.0 111.918 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -140.74 144.09 35.33 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -130.49 131.89 64.9 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.412 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -138.35 131.96 30.8 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 176.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 66.8 p -129.56 157.88 40.84 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.31 1.053 . . . . 0.0 109.431 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -121.74 133.79 54.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 95.6 m -155.89 140.75 17.17 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.68 100.86 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-O 122.503 1.145 . . . . 0.0 109.924 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -99.54 164.44 16.61 Favored Pre-proline 0 C--N 1.354 0.786 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -52.41 155.76 9.27 Favored 'Trans proline' 0 C--O 1.206 -1.123 0 C-N-CA 122.249 1.966 . . . . 0.0 115.649 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.26 -53.66 37.25 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.04 -6.64 18.83 Favored 'Trans proline' 0 C--N 1.351 0.707 0 CA-C-N 121.247 1.481 . . . . 0.0 112.704 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.18 24.54 11.09 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.845 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.92 71.0 2.71 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -120.74 153.27 37.22 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.965 0.888 . . . . 0.0 109.976 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -95.38 135.17 37.33 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 178.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -111.11 131.32 55.18 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 121.94 2.154 . . . . 0.0 109.536 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.4 t -125.2 136.94 54.07 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.28 125.24 53.05 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.2 mt -126.55 129.18 48.09 Favored 'General case' 0 C--N 1.353 0.758 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.04 137.86 40.67 Favored 'General case' 0 C--N 1.356 0.874 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -85.79 110.04 19.08 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 121.369 -0.832 . . . . 0.0 109.667 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.0 t30 65.55 26.61 11.67 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 123.707 0.803 . . . . 0.0 109.948 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 65.08 24.1 12.48 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 123.519 0.728 . . . . 0.0 110.873 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.28 115.84 28.43 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.36 -26.08 68.25 Favored 'General case' 0 C--N 1.356 0.88 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -75.34 -14.62 60.49 Favored 'General case' 0 C--N 1.362 1.135 0 O-C-N 121.307 -0.871 . . . . 0.0 109.713 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.8 mt -116.53 84.26 2.1 Favored 'General case' 0 C--N 1.351 0.637 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.6 m -119.63 129.68 54.71 Favored 'General case' 0 C--N 1.361 1.081 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -109.39 133.17 53.4 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.58 109.29 15.99 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 103.467 -2.79 . . . . 0.0 103.467 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -119.02 117.7 55.15 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -176.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.34 140.63 45.22 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.3 mp -154.2 161.57 28.97 Favored Pre-proline 0 C--O 1.242 0.666 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 -179.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -53.27 145.91 42.37 Favored 'Trans proline' 0 CA--C 1.508 -0.813 0 C-N-CA 122.059 1.839 . . . . 0.0 111.788 176.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -60.51 -20.21 59.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.084 -1.01 . . . . 0.0 113.51 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -87.95 -22.82 24.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.682 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -95.69 -33.71 12.22 Favored 'General case' 0 C--N 1.361 1.084 0 O-C-N 121.821 -0.549 . . . . 0.0 111.069 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.85 -41.22 97.57 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -175.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.7 -32.7 73.83 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 120.678 -1.264 . . . . 0.0 111.228 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.36 -41.16 79.58 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.688 1.131 . . . . 0.0 109.753 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -66.87 -41.35 87.44 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 121.698 -0.626 . . . . 0.0 109.951 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -43.05 98.97 Favored 'General case' 0 C--N 1.357 0.921 0 CA-C-O 120.525 0.202 . . . . 0.0 111.018 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -43.84 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.642 -0.661 . . . . 0.0 109.378 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.99 -40.65 96.36 Favored 'General case' 0 C--N 1.363 1.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.056 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.9 ttp -62.66 -47.92 81.57 Favored 'General case' 0 C--N 1.356 0.855 0 CA-C-O 120.995 0.426 . . . . 0.0 110.794 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.87 -44.73 80.18 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 121.516 0.674 . . . . 0.0 109.709 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -62.17 -48.64 79.16 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.293 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.73 -46.6 93.34 Favored Glycine 0 C--N 1.354 1.562 0 O-C-N 121.243 -0.911 . . . . 0.0 113.753 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.443 ' HB3' HG13 ' A' ' 48' ' ' VAL . 56.4 m-85 -87.46 -39.28 15.35 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 119.54 1.67 . . . . 0.0 113.436 -176.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -82.51 -52.17 7.11 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.249 -1.532 . . . . 0.0 112.036 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -63.68 -41.75 98.13 Favored 'General case' 0 C--N 1.357 0.927 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 22.4 mmt -87.53 -22.72 24.69 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 121.017 -1.052 . . . . 0.0 110.714 -176.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 61.12 36.63 18.14 Favored 'General case' 0 C--N 1.366 1.31 0 CA-C-O 122.327 1.061 . . . . 0.0 110.854 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -116.16 140.37 49.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.327 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 t -89.19 -7.42 55.65 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -86.34 108.86 18.63 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -78.86 151.96 76.94 Favored Pre-proline 0 C--N 1.351 0.661 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.66 139.58 76.15 Favored 'Trans proline' 0 CA--C 1.517 -0.337 0 C-N-CA 121.668 1.579 . . . . 0.0 113.434 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.42 96.05 Favored Glycine 0 C--N 1.357 1.727 0 O-C-N 121.903 -0.498 . . . . 0.0 112.388 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.4 -34.07 75.38 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.612 1.206 . . . . 0.0 109.943 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -70.14 -40.03 75.05 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -71.21 -30.41 66.35 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 121.946 -0.471 . . . . 0.0 110.332 -178.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -60.72 -49.73 76.33 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.756 0.788 . . . . 0.0 110.05 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -67.16 -41.47 85.94 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.347 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.14 -41.27 74.1 Favored 'General case' 0 C--N 1.357 0.921 0 O-C-N 121.889 -0.507 . . . . 0.0 111.108 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.0 tp -69.71 -40.22 76.39 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 121.713 -0.617 . . . . 0.0 109.91 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.54 32.51 13.27 Favored Glycine 0 C--N 1.366 2.223 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -102.77 117.69 35.19 Favored 'General case' 0 C--N 1.351 0.662 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -82.02 96.25 7.67 Favored 'General case' 0 C--N 1.348 0.518 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 20.5 t . . . . . 0 C--O 1.269 2.123 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.236 179.499 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.9 tpt . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 121.479 0.657 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -148.85 165.31 31.89 Favored 'General case' 0 C--N 1.36 1.045 0 O-C-N 121.315 -0.866 . . . . 0.0 109.138 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.8 mm -61.47 -36.7 74.86 Favored 'Isoleucine or valine' 0 C--N 1.364 1.204 0 C-N-CA 124.088 0.955 . . . . 0.0 110.705 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -63.52 -15.06 56.87 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -176.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -91.69 -4.43 55.15 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 121.44 -0.787 . . . . 0.0 109.323 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.3 mt -106.37 -107.44 0.31 Allowed 'General case' 0 C--N 1.35 0.59 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.708 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -90.69 158.01 43.14 Favored Pre-proline 0 C--N 1.345 0.401 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 179.259 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.708 ' HD2' HG22 ' A' ' 7' ' ' VAL . 75.3 Cg_exo -56.5 128.11 28.7 Favored 'Trans proline' 0 N--CA 1.477 0.537 0 CA-C-N 119.703 0.93 . . . . 0.0 112.416 176.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.14 119.82 24.07 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 123.138 1.447 . . . . 0.0 111.905 -176.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -83.5 162.72 52.54 Favored Pre-proline 0 N--CA 1.443 -0.805 0 CA-C-N 113.484 -1.689 . . . . 0.0 106.716 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -55.86 -26.52 58.07 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 122.361 2.04 . . . . 0.0 113.401 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -72.54 -50.52 25.1 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 108.578 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -46.01 85.37 Favored 'General case' 0 C--N 1.363 1.169 0 C-N-CA 125.612 1.565 . . . . 0.0 110.935 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -61.04 -43.24 95.76 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.685 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.9 m -71.91 -36.86 70.11 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.187 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.22 -39.1 82.45 Favored 'General case' 0 C--N 1.37 1.461 0 O-C-N 121.325 -0.859 . . . . 0.0 110.199 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.403 ' CD1' HD21 ' A' ' 34' ' ' LEU . 70.3 t80 -74.24 -16.27 60.96 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.817 -0.552 . . . . 0.0 112.184 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.7 m -61.8 -52.03 71.59 Favored Pre-proline 0 N--CA 1.486 1.372 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -60.96 142.6 98.03 Favored 'Trans proline' 0 N--CA 1.487 1.113 0 CA-C-N 121.553 1.59 . . . . 0.0 115.439 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.418 ' CD1' HD22 ' A' ' 30' ' ' LEU . 74.0 t80 -142.57 128.92 20.0 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -120.52 138.2 53.97 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.8 t -165.29 155.23 13.13 Favored 'General case' 0 C--N 1.353 0.755 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -91.9 -7.46 49.17 Favored 'General case' 0 C--N 1.358 0.935 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.77 -86.58 0.03 OUTLIER 'General case' 0 C--N 1.356 0.89 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -166.07 166.57 17.09 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 177.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 66.94 52.3 0.91 Allowed 'General case' 0 C--N 1.364 1.218 0 CA-C-O 121.992 0.901 . . . . 0.0 109.346 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -84.37 121.03 26.96 Favored 'General case' 0 C--N 1.36 1.056 0 O-C-N 121.232 -0.917 . . . . 0.0 109.009 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.7 ptt180 -64.66 -16.73 63.24 Favored 'General case' 0 C--N 1.359 1.02 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -69.11 -35.12 76.1 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 121.258 -0.901 . . . . 0.0 111.584 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.418 HD22 ' CD1' ' A' ' 20' ' ' TYR . 62.9 tp -64.1 -57.06 19.7 Favored Pre-proline 0 C--N 1.365 1.24 0 O-C-N 121.463 -0.773 . . . . 0.0 112.399 -178.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.92 -17.26 32.45 Favored 'Trans proline' 0 C--N 1.355 0.921 0 CA-C-N 120.638 1.263 . . . . 0.0 114.957 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -68.32 -37.19 80.33 Favored 'General case' 0 C--N 1.359 1.007 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.44 -18.5 60.63 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 121.957 -0.465 . . . . 0.0 110.039 -177.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.403 HD21 ' CD1' ' A' ' 17' ' ' TYR . 94.5 mt -72.38 -22.32 61.15 Favored 'General case' 0 C--N 1.36 1.051 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 66.0 m -84.77 -25.39 28.25 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.591 ' CD2' HD11 ' A' ' 42' ' ' ILE . 6.4 mp -74.92 -41.34 59.88 Favored 'General case' 0 C--N 1.358 0.958 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.97 -29.14 59.78 Favored 'General case' 0 C--N 1.358 0.94 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.638 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -64.01 -13.32 45.83 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 121.285 -0.884 . . . . 0.0 112.79 -177.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.64 2.36 14.82 Favored Glycine 0 C--N 1.376 2.777 0 CA-C-N 119.953 1.251 . . . . 0.0 110.854 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.6 m -70.4 -42.17 72.04 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-N 118.531 1.165 . . . . 0.0 109.975 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 t 64.83 -175.9 0.17 Allowed 'General case' 0 C--N 1.372 1.572 0 CA-C-O 121.477 0.656 . . . . 0.0 110.943 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.591 HD11 ' CD2' ' A' ' 36' ' ' LEU . 2.8 mp -138.27 125.97 29.03 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -152.35 126.91 9.41 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.451 -2.796 . . . . 0.0 103.451 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.83 -169.02 40.8 Favored Glycine 0 CA--C 1.494 -1.245 0 N-CA-C 108.667 -1.773 . . . . 0.0 108.667 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 68.8 m -122.1 117.17 25.65 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -95.04 130.78 41.58 Favored 'General case' 0 C--N 1.355 0.807 0 N-CA-C 107.424 -1.325 . . . . 0.0 107.424 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.93 118.71 23.17 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-O 122.725 1.25 . . . . 0.0 109.8 -177.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.566 HG13 ' HB3' ' A' ' 104' ' ' TYR . 81.4 t -101.86 115.33 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.236 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 177.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -71.13 138.46 49.67 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.628 0.728 . . . . 0.0 109.479 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.21 -8.55 62.8 Favored Glycine 0 C--N 1.36 1.874 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.97 -103.53 0.55 Allowed Glycine 0 C--N 1.356 1.642 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.83 159.48 22.32 Favored Pre-proline 0 N--CA 1.447 -0.58 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.18 123.72 7.99 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.382 1.388 . . . . 0.0 112.84 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.4 pt -109.1 137.1 42.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.841 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 77.3 p -67.78 148.02 51.8 Favored 'General case' 0 C--N 1.364 1.206 0 CA-C-O 122.695 1.236 . . . . 0.0 112.188 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -145.8 146.52 31.21 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -129.86 130.76 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.75 135.79 35.06 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -134.99 154.1 51.85 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.406 1.098 . . . . 0.0 109.781 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.26 124.94 35.72 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.8 m -152.63 151.48 30.66 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 103.311 -2.848 . . . . 0.0 103.311 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.57 101.31 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 122.525 1.155 . . . . 0.0 111.177 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.1 p -99.25 157.34 34.21 Favored Pre-proline 0 C--N 1.352 0.717 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 176.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -50.46 151.05 10.58 Favored 'Trans proline' 0 CA--C 1.498 -1.293 0 C-N-CA 122.092 1.862 . . . . 0.0 115.586 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 tp -45.74 -52.97 22.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.01 -6.66 18.87 Favored 'Trans proline' 0 C--N 1.352 0.746 0 CA-C-N 121.582 1.601 . . . . 0.0 113.127 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.6 25.91 10.08 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 43.8 p-10 -72.67 63.41 0.6 Allowed 'General case' 0 C--N 1.374 1.635 0 CA-C-O 121.822 0.82 . . . . 0.0 111.328 -177.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -116.39 153.39 32.13 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 122.107 0.956 . . . . 0.0 110.244 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.8 m -96.72 135.8 38.14 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 104.829 -2.286 . . . . 0.0 104.829 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -113.32 132.51 55.54 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.285 2.311 . . . . 0.0 109.914 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 12.3 t -125.73 138.3 53.86 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -115.88 125.05 52.11 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 177.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.5 mt -127.07 128.15 45.82 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -104.84 135.78 45.57 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -85.99 114.3 22.77 Favored 'General case' 0 C--N 1.345 0.409 0 O-C-N 121.398 -0.814 . . . . 0.0 109.622 -177.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 63.58 25.52 14.39 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 123.825 0.85 . . . . 0.0 110.552 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 63.71 27.82 14.82 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 123.452 0.701 . . . . 0.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -96.36 114.29 25.95 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.03 -25.52 67.71 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -74.0 -16.71 61.05 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.265 -0.897 . . . . 0.0 109.416 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.7 mt -114.55 80.84 1.46 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 106.851 -1.536 . . . . 0.0 106.851 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.7 m -118.87 128.56 54.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -177.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -110.0 133.43 53.2 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -117.45 109.66 17.03 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 103.224 -2.88 . . . . 0.0 103.224 178.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.0 mm -118.82 118.74 58.79 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.165 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.14 141.57 45.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mp -150.67 160.32 32.77 Favored Pre-proline 0 CA--C 1.51 -0.562 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 -178.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -52.78 149.73 24.57 Favored 'Trans proline' 0 N--CA 1.482 0.848 0 C-N-CA 122.116 1.877 . . . . 0.0 111.273 176.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -62.35 -18.49 61.62 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.701 -1.25 . . . . 0.0 113.778 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -88.94 -22.94 22.82 Favored 'General case' 0 C--N 1.35 0.619 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -95.31 -30.13 14.11 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 122.002 -0.436 . . . . 0.0 110.772 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -64.66 -40.17 94.96 Favored 'General case' 0 C--N 1.364 1.196 0 O-C-N 121.919 -0.488 . . . . 0.0 111.62 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.28 -37.81 88.83 Favored 'General case' 0 C--N 1.36 1.041 0 O-C-N 120.355 -1.466 . . . . 0.0 109.814 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -58.98 -41.18 86.95 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 120.051 1.296 . . . . 0.0 109.487 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -61.03 -48.98 79.25 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 123.828 0.851 . . . . 0.0 109.939 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -40.94 88.16 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.021 0.528 . . . . 0.0 112.133 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.8 -46.91 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.57 -0.706 . . . . 0.0 109.851 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.77 -42.55 99.74 Favored 'General case' 0 C--N 1.359 0.994 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.395 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 64.2 ttp -63.52 -48.32 78.02 Favored 'General case' 0 C--N 1.356 0.873 0 CA-C-O 121.006 0.431 . . . . 0.0 110.859 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.6 tp -64.75 -49.16 71.88 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.367 0.603 . . . . 0.0 110.532 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.3 ttp -61.78 -50.28 72.97 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 122.834 0.453 . . . . 0.0 112.035 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.36 -44.69 97.72 Favored Glycine 0 C--N 1.359 1.812 0 CA-C-O 119.048 -0.862 . . . . 0.0 114.748 -174.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.566 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.0 m-85 -84.6 -32.3 23.82 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.707 1.753 . . . . 0.0 112.085 -176.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -83.47 -50.63 8.1 Favored 'General case' 0 C--N 1.35 0.592 0 O-C-N 120.79 -1.194 . . . . 0.0 111.5 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.8 ttt180 -63.37 -42.49 98.87 Favored 'General case' 0 C--N 1.358 0.97 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 38.7 mmt -82.33 -21.33 36.08 Favored 'General case' 0 C--N 1.368 1.407 0 O-C-N 120.757 -1.215 . . . . 0.0 110.395 -177.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 60.93 39.06 17.15 Favored 'General case' 0 C--N 1.369 1.427 0 CA-C-O 122.472 1.13 . . . . 0.0 110.494 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -137.32 145.69 43.72 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.033 -1.44 . . . . 0.0 107.239 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.3 m -95.83 56.34 1.72 Allowed 'General case' 0 C--N 1.358 0.939 0 CA-C-O 122.308 1.051 . . . . 0.0 108.252 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -127.09 132.95 50.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -105.55 148.15 35.87 Favored Pre-proline 0 C--N 1.349 0.582 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -65.06 141.56 70.61 Favored 'Trans proline' 0 CA--C 1.518 -0.287 0 C-N-CA 121.255 1.303 . . . . 0.0 112.191 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -39.56 97.42 Favored Glycine 0 C--N 1.357 1.731 0 O-C-N 121.818 -0.551 . . . . 0.0 112.769 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.33 -31.59 68.95 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 118.637 1.218 . . . . 0.0 109.926 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -71.16 -33.26 69.86 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -73.53 -17.46 61.2 Favored 'General case' 0 C--N 1.363 1.19 0 O-C-N 121.596 -0.69 . . . . 0.0 111.005 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -65.96 -43.01 89.18 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -64.76 -39.07 93.01 Favored 'General case' 0 C--N 1.353 0.725 0 CA-C-N 113.168 -1.833 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.12 -43.84 66.82 Favored 'General case' 0 C--N 1.359 0.983 0 O-C-N 121.839 -0.538 . . . . 0.0 110.202 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.5 tp -68.25 -40.62 81.88 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.696 0.398 . . . . 0.0 110.551 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 100.32 36.42 4.12 Favored Glycine 0 C--N 1.36 1.898 0 N-CA-C 107.918 -2.073 . . . . 0.0 107.918 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -103.32 121.85 43.6 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -82.81 95.9 8.05 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.263 1.798 0 CA-C-O 118.334 -0.841 . . . . 0.0 109.924 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.5 ttp . . . . . 0 N--CA 1.502 2.165 0 CA-C-O 121.688 0.756 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -150.29 160.0 44.04 Favored 'General case' 0 C--N 1.36 1.05 0 O-C-N 121.047 -1.033 . . . . 0.0 109.609 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.0 pt -70.5 -14.15 17.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.478 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.49 -10.47 59.82 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 121.082 -1.011 . . . . 0.0 110.168 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -91.03 -4.66 56.19 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.8 mt -107.16 -114.25 0.27 Allowed 'General case' 0 C--N 1.354 0.783 0 CA-C-O 121.851 0.834 . . . . 0.0 108.773 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.721 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -89.98 157.94 45.15 Favored Pre-proline 0 C--N 1.346 0.445 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.721 ' HD2' HG22 ' A' ' 7' ' ' VAL . 71.2 Cg_exo -56.04 128.8 31.74 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 120.845 1.03 . . . . 0.0 112.283 176.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.86 118.5 20.95 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-O 123.309 1.528 . . . . 0.0 112.552 -175.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -84.78 161.56 52.91 Favored Pre-proline 0 N--CA 1.443 -0.81 0 CA-C-N 113.252 -1.795 . . . . 0.0 106.328 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.41 -18.18 51.86 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 122.036 1.824 . . . . 0.0 113.568 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -79.07 -52.86 7.63 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.04 1.336 . . . . 0.0 107.624 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.9 -45.93 74.76 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 125.564 1.546 . . . . 0.0 110.987 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.6 t -60.45 -41.17 86.56 Favored 'Isoleucine or valine' 0 C--N 1.351 0.66 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.242 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 60.6 m -78.85 -19.26 52.45 Favored 'General case' 0 C--N 1.365 1.252 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.794 -175.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.2 mt -83.92 -43.38 15.32 Favored 'General case' 0 C--N 1.368 1.371 0 CA-C-N 119.283 0.947 . . . . 0.0 108.615 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -65.32 -42.25 93.18 Favored 'General case' 0 C--N 1.352 0.687 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 56.5 m -53.26 -53.15 59.22 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -83.8 76.02 3.88 Favored 'Trans proline' 0 C--O 1.233 0.252 0 CA-C-N 121.551 1.59 . . . . 0.0 113.859 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HB3' HD13 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -73.05 117.52 14.88 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-O 121.572 0.701 . . . . 0.0 109.6 179.815 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -94.25 126.35 39.45 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.5 m -152.48 136.08 16.09 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -95.49 70.63 3.1 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -172.11 -176.58 1.68 Allowed 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -97.45 13.18 30.72 Favored 'General case' 0 C--N 1.357 0.912 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.0 tpt180 -141.47 145.3 35.07 Favored 'General case' 0 C--N 1.352 0.708 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -79.84 70.95 6.47 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -77.07 -12.8 59.99 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -100.53 -17.3 17.17 Favored 'General case' 0 C--N 1.363 1.187 0 O-C-N 121.318 -0.864 . . . . 0.0 110.109 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.439 HD13 ' HB3' ' A' ' 20' ' ' TYR . 62.4 tp -62.39 -51.61 72.11 Favored Pre-proline 0 C--N 1.358 0.936 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.7 -23.01 63.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-N 121.048 1.41 . . . . 0.0 115.633 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -76.69 -28.7 55.99 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 121.359 -0.838 . . . . 0.0 108.838 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.78 -18.65 50.5 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.43 -16.95 61.3 Favored 'General case' 0 C--N 1.359 0.999 0 O-C-N 121.001 -1.062 . . . . 0.0 108.658 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.9 m -85.09 -17.19 38.12 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.55 ' CD2' HD11 ' A' ' 42' ' ' ILE . 7.7 mp -86.13 -47.67 9.3 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -67.3 -11.53 57.81 Favored 'General case' 0 C--N 1.363 1.17 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.051 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -73.11 -12.26 60.84 Favored 'General case' 0 C--N 1.362 1.109 0 O-C-N 120.749 -1.219 . . . . 0.0 109.034 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.6 10.23 9.54 Favored Glycine 0 C--N 1.377 2.85 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -71.24 -45.54 63.02 Favored 'General case' 0 C--N 1.355 0.848 0 CA-C-N 118.718 1.259 . . . . 0.0 110.935 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.5 t 66.56 177.17 0.23 Allowed 'General case' 0 C--N 1.374 1.636 0 CA-C-O 121.19 0.519 . . . . 0.0 109.795 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.55 HD11 ' CD2' ' A' ' 36' ' ' LEU . 1.6 mp -140.53 129.03 25.04 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 O-C-N 120.642 -1.287 . . . . 0.0 108.931 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -154.65 125.76 7.24 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.3 -168.74 40.65 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 108.545 -1.822 . . . . 0.0 108.545 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 p -121.15 114.92 22.13 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -93.95 131.2 39.64 Favored 'General case' 0 C--N 1.355 0.83 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.95 126.37 31.86 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.762 1.268 . . . . 0.0 109.522 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.501 HG13 ' HB3' ' A' ' 104' ' ' TYR . 93.4 t -110.46 116.85 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.0 mp0 -73.31 135.54 44.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 94.83 9.42 58.54 Favored Glycine 0 C--N 1.359 1.837 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.96 -107.89 0.26 Allowed Glycine 0 CA--C 1.492 -1.386 0 N-CA-C 109.045 -1.622 . . . . 0.0 109.045 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.4 159.19 20.59 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.93 122.55 7.31 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.32 1.347 . . . . 0.0 112.622 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.0 pt -109.97 137.27 42.99 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 CA-C-O 122.152 0.977 . . . . 0.0 108.776 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.9 m -65.19 140.76 58.79 Favored 'General case' 0 C--N 1.365 1.271 0 CA-C-O 122.143 0.973 . . . . 0.0 111.541 178.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.05 143.5 36.4 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.6 t -129.34 132.6 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.532 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -136.32 128.65 30.11 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 177.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 p -127.97 164.58 22.01 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.874 0.845 . . . . 0.0 108.779 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 65.1 p-90 -137.22 153.94 50.28 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.558 HG23 HG23 ' A' ' 63' ' ' THR . 15.3 t -164.41 148.04 9.32 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 176.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -76.62 99.5 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 122.593 1.187 . . . . 0.0 108.994 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.558 HG23 HG23 ' A' ' 61' ' ' THR . 1.1 p -99.84 160.49 27.15 Favored Pre-proline 0 C--N 1.356 0.853 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -51.79 153.46 11.41 Favored 'Trans proline' 0 CA--C 1.501 -1.128 0 C-N-CA 122.175 1.917 . . . . 0.0 115.401 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.0 tp -41.09 -54.78 5.43 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.45 -8.48 22.69 Favored 'Trans proline' 0 C--N 1.353 0.789 0 CA-C-N 121.494 1.569 . . . . 0.0 113.303 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.41 24.0 11.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.03 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.76 73.85 3.41 Favored 'General case' 0 C--N 1.375 1.704 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.4 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 58.7 mtt -123.98 153.86 40.65 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.043 0.925 . . . . 0.0 110.886 -176.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.7 m -92.84 137.84 32.01 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -115.13 129.68 56.73 Favored 'General case' 0 C--N 1.364 1.21 0 CA-C-N 122.006 2.184 . . . . 0.0 109.456 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 8.9 t -125.33 140.62 52.66 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-O 122.048 0.928 . . . . 0.0 108.714 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -118.85 124.24 46.67 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 mt -126.45 127.43 45.39 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -100.77 138.91 37.19 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 179.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -85.93 112.14 20.9 Favored 'General case' 0 C--N 1.347 0.47 0 O-C-N 121.395 -0.815 . . . . 0.0 109.113 -177.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.9 25.85 15.27 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 123.755 0.822 . . . . 0.0 110.58 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 66.44 22.48 10.71 Favored 'General case' 0 C--N 1.371 1.533 0 C-N-CA 123.555 0.742 . . . . 0.0 110.864 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -91.87 115.6 28.2 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.43 -24.98 67.72 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -75.55 -14.34 60.4 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 121.331 -0.856 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.0 mt -117.08 87.06 2.62 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -122.07 131.67 54.1 Favored 'General case' 0 C--N 1.359 1.022 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -108.54 130.56 55.28 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -118.54 107.88 14.3 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 103.082 -2.932 . . . . 0.0 103.082 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 51.3 mm -122.91 120.18 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.0 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 -175.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.81 140.12 45.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.4 mp -152.33 161.08 30.31 Favored Pre-proline 0 C--O 1.238 0.486 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.4 ' HA ' ' HA ' ' A' ' 69' ' ' MET . 82.7 Cg_exo -52.82 147.87 30.72 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.2 1.933 . . . . 0.0 112.571 177.313 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -19.27 58.11 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.926 -1.109 . . . . 0.0 112.893 -175.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.7 p-80 -89.43 -24.54 21.86 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 121.573 -0.704 . . . . 0.0 109.587 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.19 -34.42 12.92 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 121.14 0.495 . . . . 0.0 111.021 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.16 -39.32 92.26 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 123.254 0.622 . . . . 0.0 112.542 -176.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.36 -31.96 73.37 Favored 'General case' 0 C--O 1.203 -1.366 0 O-C-N 120.509 -1.37 . . . . 0.0 110.333 -177.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.34 -42.01 85.9 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 119.862 1.21 . . . . 0.0 109.425 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -61.96 -47.7 83.69 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 123.093 0.557 . . . . 0.0 109.543 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -43.55 98.38 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.712 -176.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -46.03 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 121.431 -0.793 . . . . 0.0 109.485 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.75 -42.64 97.79 Favored 'General case' 0 C--N 1.361 1.097 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.02 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.2 ttp -62.32 -50.14 72.83 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 123.166 0.586 . . . . 0.0 111.27 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -65.67 -48.02 73.5 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-O 121.397 0.618 . . . . 0.0 111.006 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mmt -63.79 -51.87 62.84 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.69 -44.87 95.75 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 -174.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.501 ' HB3' HG13 ' A' ' 48' ' ' VAL . 49.3 m-85 -75.78 -36.84 59.67 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 119.37 1.585 . . . . 0.0 110.738 -176.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -73.78 -45.15 53.45 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 121.793 -0.567 . . . . 0.0 110.845 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -65.35 -46.28 80.82 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.8 mtm -85.4 -22.34 28.42 Favored 'General case' 0 C--N 1.367 1.347 0 O-C-N 120.811 -1.181 . . . . 0.0 111.194 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 60.11 38.64 20.31 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-O 122.338 1.066 . . . . 0.0 110.752 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -137.18 139.52 41.17 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.2 m -94.45 56.31 2.1 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -137.41 108.36 6.71 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.65 154.8 39.81 Favored Pre-proline 0 C--N 1.354 0.764 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -59.96 146.61 95.5 Favored 'Trans proline' 0 N--CA 1.475 0.413 0 C-N-CA 122.027 1.818 . . . . 0.0 113.696 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -66.33 -16.6 65.13 Favored Glycine 0 C--N 1.361 1.966 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.949 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.2 -33.45 73.35 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-N 119.125 1.463 . . . . 0.0 109.3 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -72.6 -34.75 67.61 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -72.26 -23.72 61.25 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.947 -0.47 . . . . 0.0 110.306 -178.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -63.78 -50.45 68.97 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-O 122.122 0.963 . . . . 0.0 109.322 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -67.58 -40.31 84.83 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.193 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -40.15 82.29 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 122.473 0.309 . . . . 0.0 110.863 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 58.4 tp -68.86 -40.93 79.05 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 121.608 -0.683 . . . . 0.0 109.755 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 94.68 13.51 53.23 Favored Glycine 0 C--N 1.366 2.204 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -102.37 116.35 32.45 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -79.71 96.27 6.19 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.3 t . . . . . 0 C--O 1.263 1.811 0 CA-C-O 118.405 -0.807 . . . . 0.0 109.449 178.717 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.3 ttm . . . . . 0 N--CA 1.503 2.223 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -151.66 159.14 44.15 Favored 'General case' 0 C--N 1.355 0.836 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.5 pt -70.82 -18.17 20.74 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.29 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -73.62 -12.57 60.79 Favored 'General case' 0 C--N 1.36 1.027 0 O-C-N 121.196 -0.94 . . . . 0.0 111.29 -177.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -95.98 -2.88 46.09 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 90.2 mt -104.27 -114.66 0.23 Allowed 'General case' 0 C--N 1.348 0.528 0 CA-C-O 121.947 0.879 . . . . 0.0 109.136 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.72 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -89.49 158.11 46.24 Favored Pre-proline 0 C--N 1.345 0.405 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.72 ' HD2' HG22 ' A' ' 7' ' ' VAL . 89.1 Cg_exo -54.84 127.81 27.78 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 120.797 0.998 . . . . 0.0 112.421 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.08 118.92 19.34 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-O 123.163 1.459 . . . . 0.0 112.5 -175.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -84.21 160.23 57.75 Favored Pre-proline 0 N--CA 1.442 -0.829 0 CA-C-N 113.384 -1.734 . . . . 0.0 106.421 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -61.46 -22.44 74.53 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 121.727 1.618 . . . . 0.0 112.666 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -73.14 -50.47 22.48 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.514 1.126 . . . . 0.0 108.647 177.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.09 -46.27 85.79 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 125.495 1.518 . . . . 0.0 110.872 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.8 t -60.64 -42.92 93.6 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.95 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -71.84 -36.5 70.18 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 119.065 -1.054 . . . . 0.0 110.466 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.6 mt -70.8 -40.28 72.63 Favored 'General case' 0 C--N 1.368 1.402 0 O-C-N 121.62 -0.675 . . . . 0.0 110.533 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -71.65 -24.68 61.9 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.0 m -58.5 -54.19 58.56 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.67 148.78 42.35 Favored 'Trans proline' 0 C--N 1.348 0.521 0 CA-C-N 121.435 1.548 . . . . 0.0 114.748 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -157.2 165.12 36.83 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -79.92 109.02 13.95 Favored 'General case' 0 C--N 1.354 0.802 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 67.5 m -86.39 60.72 6.4 Favored 'General case' 0 C--N 1.358 0.97 0 O-C-N 121.537 -0.727 . . . . 0.0 109.543 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -98.45 -19.16 17.85 Favored 'General case' 0 C--N 1.356 0.852 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.31 173.86 15.6 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -63.49 -38.65 91.94 Favored 'General case' 0 C--N 1.364 1.224 0 CA-C-O 120.593 0.235 . . . . 0.0 110.46 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -122.97 137.67 54.89 Favored 'General case' 0 C--N 1.354 0.794 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -116.31 128.66 55.75 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.4 mmm180 -62.58 -37.21 85.3 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 123.02 0.528 . . . . 0.0 111.681 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -67.0 -26.33 66.74 Favored 'General case' 0 C--N 1.351 0.645 0 O-C-N 121.496 -0.753 . . . . 0.0 112.473 -178.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.91 -61.06 8.76 Favored Pre-proline 0 C--N 1.364 1.231 0 CA-C-N 119.112 0.869 . . . . 0.0 112.738 -177.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -73.26 -18.69 23.22 Favored 'Trans proline' 0 C--N 1.351 0.692 0 CA-C-N 120.473 1.205 . . . . 0.0 115.06 -179.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -72.85 -30.7 64.21 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 121.473 -0.767 . . . . 0.0 109.517 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.05 -18.07 56.26 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.8 mt -66.07 -36.58 83.58 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.515 -0.74 . . . . 0.0 109.028 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -63.08 -37.98 89.36 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.919 -0.488 . . . . 0.0 109.865 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.644 HD23 HD11 ' A' ' 42' ' ' ILE . 7.1 mp -68.41 -43.91 76.17 Favored 'General case' 0 C--N 1.361 1.091 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -56.27 -35.82 67.87 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.505 1.122 . . . . 0.0 112.09 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.87 -27.73 69.0 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.56 -0.713 . . . . 0.0 111.54 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 133.49 12.12 1.63 Allowed Glycine 0 C--N 1.354 1.572 0 C-N-CA 120.0 -1.095 . . . . 0.0 111.246 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.1 m -68.93 -43.45 75.1 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 118.817 1.309 . . . . 0.0 109.669 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 t 65.58 176.03 0.21 Allowed 'General case' 0 C--N 1.374 1.662 0 CA-C-O 121.7 0.762 . . . . 0.0 111.056 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.644 HD11 HD23 ' A' ' 36' ' ' LEU . 2.2 mp -139.05 125.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -151.43 125.59 9.3 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 103.016 -2.957 . . . . 0.0 103.016 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.04 -169.89 41.9 Favored Glycine 0 CA--C 1.491 -1.436 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 -178.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.0 m -121.25 115.28 22.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -92.19 130.6 37.87 Favored 'General case' 0 C--N 1.357 0.913 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.99 122.34 27.17 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 122.904 1.335 . . . . 0.0 110.277 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.627 HG13 ' HB3' ' A' ' 104' ' ' TYR . 96.6 t -106.15 115.87 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.275 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -71.33 139.28 49.82 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.631 0.729 . . . . 0.0 109.677 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.91 -8.96 63.63 Favored Glycine 0 C--N 1.361 1.961 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -140.1 -102.85 0.53 Allowed Glycine 0 C--N 1.354 1.581 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.65 158.97 22.83 Favored Pre-proline 0 N--CA 1.448 -0.545 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.64 126.25 9.44 Favored 'Trans proline' 0 CA--C 1.513 -0.535 0 C-N-CA 121.427 1.418 . . . . 0.0 112.789 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.6 pt -109.56 136.43 45.49 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 CA-C-O 122.042 0.925 . . . . 0.0 108.793 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 61.1 m -64.66 140.84 58.91 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 122.141 0.972 . . . . 0.0 112.041 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -140.58 143.88 35.54 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.1 t -129.88 131.08 66.59 Favored 'Isoleucine or valine' 0 C--N 1.353 0.743 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.96 129.29 27.72 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 176.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -128.73 132.29 47.96 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -178.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.61 127.79 50.98 Favored 'General case' 0 C--N 1.352 0.689 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.5 m -153.59 148.35 26.42 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 103.517 -2.771 . . . . 0.0 103.517 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.65 102.91 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.216 0 CA-C-O 122.446 1.117 . . . . 0.0 111.019 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.1 p -99.03 158.58 32.05 Favored Pre-proline 0 C--N 1.354 0.765 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -49.87 155.59 4.0 Favored 'Trans proline' 0 C--O 1.203 -1.274 0 C-N-CA 122.605 2.204 . . . . 0.0 115.831 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.58 -51.15 75.99 Favored Pre-proline 0 N--CA 1.474 0.737 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.76 -4.57 15.61 Favored 'Trans proline' 0 CA--C 1.512 -0.577 0 CA-C-N 121.162 1.451 . . . . 0.0 112.15 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.93 26.15 9.87 Favored 'General case' 0 C--N 1.348 0.516 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.383 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.6 p-10 -73.02 61.94 0.6 Allowed 'General case' 0 C--N 1.374 1.633 0 CA-C-O 121.86 0.838 . . . . 0.0 111.184 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.426 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 58.9 mtt -117.44 153.29 33.36 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 122.003 0.906 . . . . 0.0 110.02 -177.358 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.9 m -96.1 135.46 37.86 Favored 'General case' 0 C--N 1.354 0.801 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 -111.5 132.03 54.79 Favored 'General case' 0 C--N 1.36 1.06 0 CA-C-N 122.095 2.225 . . . . 0.0 109.896 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.2 t -125.62 138.72 53.93 Favored 'General case' 0 C--N 1.35 0.616 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -116.63 125.19 51.43 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.33 130.73 50.02 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -104.48 138.94 40.11 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -85.85 113.29 21.88 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 121.232 -0.917 . . . . 0.0 109.477 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.9 t30 63.24 26.64 15.25 Favored 'General case' 0 C--N 1.373 1.596 0 C-N-CA 123.584 0.754 . . . . 0.0 110.018 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 65.68 23.49 11.6 Favored 'General case' 0 C--N 1.372 1.584 0 C-N-CA 123.557 0.743 . . . . 0.0 110.978 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -92.82 115.41 28.08 Favored 'General case' 0 C--N 1.353 0.759 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.98 -24.41 67.89 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -74.29 -16.48 60.93 Favored 'General case' 0 C--N 1.362 1.112 0 O-C-N 121.342 -0.849 . . . . 0.0 109.29 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.0 mt -115.48 87.21 2.62 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.5 m -120.7 130.5 54.11 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -177.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -109.23 132.69 53.89 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -119.01 108.5 14.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 103.23 -2.878 . . . . 0.0 103.23 177.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.7 mm -120.36 119.51 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.92 141.86 46.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.48 160.66 31.45 Favored Pre-proline 0 C--O 1.238 0.467 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 69' ' ' MET . 80.1 Cg_exo -53.83 151.2 26.99 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 122.246 1.964 . . . . 0.0 111.889 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.88 -18.02 53.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.639 -1.288 . . . . 0.0 113.312 -175.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -89.62 -28.45 19.5 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.359 -0.838 . . . . 0.0 108.89 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -92.26 -28.66 16.85 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 121.7 -0.625 . . . . 0.0 111.015 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.32 -38.75 92.15 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 121.676 -0.64 . . . . 0.0 111.591 -177.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.405 ' O ' HG13 ' A' ' 98' ' ' ILE . 8.6 mp -66.45 -32.89 74.54 Favored 'General case' 0 C--O 1.202 -1.426 0 O-C-N 120.488 -1.382 . . . . 0.0 109.66 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.58 -42.52 88.2 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 119.864 1.211 . . . . 0.0 109.024 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -62.65 -48.75 77.98 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.936 0.894 . . . . 0.0 110.243 175.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -43.08 99.44 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -176.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -63.54 -41.03 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 121.343 -0.848 . . . . 0.0 109.756 179.935 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.96 -39.6 92.69 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.925 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -63.44 -49.06 75.19 Favored 'General case' 0 C--N 1.362 1.146 0 CA-C-O 121.112 0.482 . . . . 0.0 110.945 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.3 -46.16 81.5 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-O 121.329 0.585 . . . . 0.0 110.087 -177.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -64.03 -50.44 68.46 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.636 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.91 -44.98 93.82 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.145 -0.808 . . . . 0.0 115.056 -175.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.627 ' HB3' HG13 ' A' ' 48' ' ' VAL . 57.6 m-85 -85.06 -33.53 22.45 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 119.753 1.776 . . . . 0.0 112.226 -175.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -81.7 -49.81 10.02 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 120.878 -1.139 . . . . 0.0 111.59 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -63.56 -44.78 93.15 Favored 'General case' 0 C--N 1.362 1.119 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -86.89 -21.28 26.43 Favored 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.841 -1.162 . . . . 0.0 110.55 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 64.28 34.95 10.28 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-O 122.488 1.137 . . . . 0.0 110.452 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -117.74 139.64 50.77 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.216 -1.357 . . . . 0.0 107.403 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 14.0 m -87.35 -16.81 33.94 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.71 124.38 27.16 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -92.87 156.28 40.79 Favored Pre-proline 0 C--N 1.348 0.532 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.9 142.26 87.65 Favored 'Trans proline' 0 CA--C 1.519 -0.266 0 C-N-CA 121.632 1.554 . . . . 0.0 113.048 177.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -38.16 95.27 Favored Glycine 0 C--N 1.358 1.754 0 O-C-N 121.844 -0.535 . . . . 0.0 112.535 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.66 72.56 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.659 1.23 . . . . 0.0 109.848 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -70.42 -33.29 71.17 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.58 -19.24 62.17 Favored 'General case' 0 C--N 1.363 1.184 0 O-C-N 121.702 -0.624 . . . . 0.0 110.98 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -64.78 -43.23 93.91 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-O 122.667 1.222 . . . . 0.0 107.995 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -65.0 -40.01 94.32 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 113.378 -1.737 . . . . 0.0 111.217 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.61 -41.79 68.46 Favored 'General case' 0 C--N 1.358 0.944 0 O-C-N 121.848 -0.533 . . . . 0.0 110.462 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.4 tp -68.3 -40.51 81.73 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 122.707 0.403 . . . . 0.0 110.491 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 101.73 34.91 4.21 Favored Glycine 0 C--N 1.36 1.884 0 N-CA-C 108.022 -2.031 . . . . 0.0 108.022 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -103.09 121.39 42.52 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -84.16 96.08 8.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.266 1.927 0 CA-C-O 118.164 -0.922 . . . . 0.0 109.881 -179.936 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.5 ttp . . . . . 0 N--CA 1.509 2.496 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -87.23 123.67 32.49 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.5 pt -67.67 -22.02 27.97 Favored 'Isoleucine or valine' 0 C--N 1.366 1.292 0 O-C-N 121.735 -0.603 . . . . 0.0 112.349 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -72.43 -13.38 61.43 Favored 'General case' 0 C--N 1.362 1.125 0 O-C-N 121.271 -0.893 . . . . 0.0 110.978 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -93.72 -5.62 48.03 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.9 mt -104.7 -105.37 0.3 Allowed 'General case' 0 C--N 1.352 0.694 0 CA-C-O 122.024 0.916 . . . . 0.0 109.06 -179.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.5 p -89.8 151.48 45.56 Favored Pre-proline 0 C--O 1.236 0.346 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.34 125.65 19.07 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-N 119.792 0.962 . . . . 0.0 111.433 175.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.37 119.42 24.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 123.143 1.449 . . . . 0.0 112.106 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -83.88 161.8 54.47 Favored Pre-proline 0 N--CA 1.442 -0.837 0 CA-C-N 113.507 -1.679 . . . . 0.0 106.559 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -56.69 -24.72 56.3 Favored 'Trans proline' 0 N--CA 1.488 1.158 0 C-N-CA 122.381 2.054 . . . . 0.0 113.664 177.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -75.29 -52.23 11.35 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.65 -47.55 73.38 Favored 'General case' 0 C--N 1.368 1.377 0 C-N-CA 125.226 1.41 . . . . 0.0 110.767 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.05 -43.78 96.9 Favored 'Isoleucine or valine' 0 C--O 1.245 0.825 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.355 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.1 m -73.19 -36.74 66.61 Favored 'General case' 0 C--N 1.366 1.296 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.756 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.5 mt -71.45 -40.95 70.01 Favored 'General case' 0 C--N 1.365 1.276 0 O-C-N 121.649 -0.657 . . . . 0.0 110.389 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.579 ' CE1' HD11 ' A' ' 30' ' ' LEU . 70.6 t80 -63.79 -39.02 93.25 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -179.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.8 m -57.48 -55.22 46.79 Favored Pre-proline 0 CA--C 1.559 1.326 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -86.48 77.54 2.26 Favored 'Trans proline' 0 C--N 1.348 0.5 0 CA-C-N 121.597 1.606 . . . . 0.0 115.635 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -124.11 151.27 44.1 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -170.16 -174.37 1.72 Allowed 'General case' 0 C--N 1.354 0.763 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.4 t -153.3 156.94 39.34 Favored 'General case' 0 C--N 1.352 0.681 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -83.62 69.58 10.15 Favored 'General case' 0 C--N 1.357 0.92 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -158.77 -78.29 0.07 Allowed 'General case' 0 C--N 1.352 0.692 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.84 -54.33 0.02 OUTLIER 'General case' 0 C--N 1.358 0.97 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.2 mtp180 -90.89 162.03 14.96 Favored 'General case' 0 C--N 1.358 0.96 0 CA-C-O 121.635 0.731 . . . . 0.0 109.078 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -83.14 75.63 9.91 Favored 'General case' 0 C--N 1.361 1.093 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mmt180 -63.45 -40.58 97.52 Favored 'General case' 0 C--N 1.354 0.794 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -73.96 -21.37 60.04 Favored 'General case' 0 C--N 1.355 0.835 0 O-C-N 121.243 -0.91 . . . . 0.0 112.663 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.579 HD11 ' CE1' ' A' ' 17' ' ' TYR . 56.3 tp -60.53 -57.01 29.64 Favored Pre-proline 0 C--N 1.358 0.974 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -176.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -70.03 -23.08 29.96 Favored 'Trans proline' 0 CA--C 1.509 -0.729 0 CA-C-N 121.233 1.476 . . . . 0.0 114.67 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -71.25 -36.38 71.76 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.21 -17.89 60.26 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.456 -177.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.4 -19.36 63.81 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.02 -1.05 . . . . 0.0 109.902 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.4 m -84.6 -17.64 38.08 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.683 HD23 HD11 ' A' ' 42' ' ' ILE . 7.5 mp -88.03 -46.12 9.61 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -57.07 -23.9 50.02 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 124.416 1.086 . . . . 0.0 112.993 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -68.47 -10.52 55.96 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 121.275 -0.891 . . . . 0.0 111.632 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.25 11.11 11.04 Favored Glycine 0 C--N 1.375 2.714 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.7 m -70.49 -43.55 69.5 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.162 0.981 . . . . 0.0 109.69 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.5 t 68.91 175.79 0.28 Allowed 'General case' 0 C--N 1.375 1.716 0 CA-C-O 121.506 0.669 . . . . 0.0 110.465 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.683 HD11 HD23 ' A' ' 36' ' ' LEU . 2.9 mp -137.39 126.25 34.56 Favored 'Isoleucine or valine' 0 C--N 1.361 1.079 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -150.51 126.62 10.56 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 103.242 -2.873 . . . . 0.0 103.242 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.71 -169.87 41.55 Favored Glycine 0 CA--C 1.491 -1.437 0 N-CA-C 108.387 -1.885 . . . . 0.0 108.387 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.0 p -122.16 115.4 22.35 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.3 tpt180 -92.36 129.59 38.26 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.53 128.13 33.24 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-O 123.017 1.389 . . . . 0.0 110.713 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.528 HG13 ' HB3' ' A' ' 104' ' ' TYR . 83.6 t -110.23 116.21 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 N-CA-C 104.122 -2.547 . . . . 0.0 104.122 177.363 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -73.47 134.31 43.88 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.65 58.29 Favored Glycine 0 C--N 1.363 2.03 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.94 -105.28 0.62 Allowed Glycine 0 C--N 1.353 1.523 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.9 158.27 24.07 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.98 126.06 9.09 Favored 'Trans proline' 0 CA--C 1.513 -0.552 0 C-N-CA 121.439 1.426 . . . . 0.0 112.708 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.2 135.86 45.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 CA-C-O 122.173 0.987 . . . . 0.0 108.703 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.2 m -64.85 141.21 58.85 Favored 'General case' 0 C--N 1.364 1.231 0 CA-C-O 122.189 0.995 . . . . 0.0 111.683 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -141.1 144.76 35.08 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.8 t -129.36 130.16 67.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.53 134.55 34.03 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.6 t -131.61 149.47 52.49 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-O 122.582 1.182 . . . . 0.0 109.449 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.5 116.62 19.97 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -178.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.8 p -140.74 161.56 37.49 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.66 100.67 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.355 0 CA-C-O 122.397 1.094 . . . . 0.0 109.327 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -99.69 161.44 24.42 Favored Pre-proline 0 C--N 1.355 0.826 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -53.31 155.17 12.9 Favored 'Trans proline' 0 C--O 1.208 -1.009 0 C-N-CA 122.129 1.886 . . . . 0.0 115.566 179.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 41.5 tp -49.29 -50.65 63.21 Favored Pre-proline 0 CA--C 1.546 0.798 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -177.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -73.33 -8.49 21.95 Favored 'Trans proline' 0 C--N 1.352 0.759 0 CA-C-N 121.204 1.466 . . . . 0.0 112.394 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.38 25.01 10.75 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.096 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -75.33 65.97 1.71 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-O 122.224 1.011 . . . . 0.0 109.066 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 72.3 mtm -120.99 153.38 37.4 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 121.86 0.838 . . . . 0.0 109.525 -177.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 60.4 m -94.44 137.24 33.82 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -115.85 129.77 56.56 Favored 'General case' 0 C--N 1.362 1.124 0 CA-C-N 122.105 2.23 . . . . 0.0 109.208 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 10.6 t -125.53 139.12 53.88 Favored 'General case' 0 C--N 1.352 0.677 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -119.71 125.59 49.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 mt -126.64 135.18 50.85 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -103.62 139.95 38.23 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.32 106.97 17.76 Favored 'General case' 0 C--N 1.344 0.358 0 O-C-N 121.259 -0.9 . . . . 0.0 109.426 -178.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.2 t30 65.52 27.35 11.66 Favored 'General case' 0 C--N 1.374 1.656 0 C-N-CA 123.654 0.782 . . . . 0.0 109.967 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 65.55 23.79 11.78 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 123.637 0.775 . . . . 0.0 110.887 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -91.73 117.66 29.96 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.24 -19.52 66.01 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -86.21 -4.88 59.26 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 121.353 -0.842 . . . . 0.0 109.727 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.4 mt -125.82 94.54 4.15 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 -178.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 81.9 p -126.07 149.63 48.75 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.067 0.936 . . . . 0.0 109.321 -176.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -127.18 132.93 50.39 Favored 'General case' 0 CA--C 1.489 -1.39 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -121.02 110.4 16.22 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 104.028 -2.582 . . . . 0.0 104.028 178.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.3 mm -120.63 116.85 51.31 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.39 139.69 44.39 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.98 162.67 26.69 Favored Pre-proline 0 C--O 1.238 0.464 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 -178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -53.25 147.81 34.47 Favored 'Trans proline' 0 N--CA 1.483 0.871 0 C-N-CA 122.372 2.048 . . . . 0.0 112.0 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -18.76 52.05 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -174.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -89.13 -27.61 20.61 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.441 -0.787 . . . . 0.0 108.955 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.69 -31.65 15.03 Favored 'General case' 0 C--N 1.356 0.885 0 O-C-N 121.769 -0.582 . . . . 0.0 111.201 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -63.71 -39.83 95.28 Favored 'General case' 0 C--N 1.36 1.027 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.59 -28.3 69.84 Favored 'General case' 0 C--N 1.365 1.249 0 O-C-N 120.492 -1.38 . . . . 0.0 110.954 -177.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.12 -40.99 87.13 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.388 0.994 . . . . 0.0 109.249 177.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -67.83 -42.98 80.64 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 123.029 0.532 . . . . 0.0 109.831 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -43.5 98.69 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -175.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -42.28 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 121.493 -0.754 . . . . 0.0 109.368 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -63.01 -39.7 95.55 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.276 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.26 -44.82 94.06 Favored 'General case' 0 C--N 1.364 1.202 0 O-C-N 121.76 -0.587 . . . . 0.0 110.831 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 81.4 mt -69.19 -44.52 71.99 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-O 121.412 0.625 . . . . 0.0 109.551 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.0 ttp -62.55 -48.91 77.4 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.387 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.84 -47.22 90.67 Favored Glycine 0 C--N 1.353 1.524 0 O-C-N 121.14 -0.975 . . . . 0.0 113.913 -176.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.528 ' HB3' HG13 ' A' ' 48' ' ' VAL . 62.0 m-85 -87.85 -38.93 15.25 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-N 119.557 1.679 . . . . 0.0 113.622 -175.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -83.59 -51.64 7.13 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 120.302 -1.499 . . . . 0.0 111.794 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -64.6 -41.67 96.07 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.7 mmt -84.52 -21.16 30.65 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.967 -1.083 . . . . 0.0 110.423 -176.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 60.37 43.47 13.39 Favored 'General case' 0 C--N 1.369 1.436 0 CA-C-O 122.395 1.093 . . . . 0.0 110.753 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -134.96 144.8 47.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.922 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.68 -9.69 48.56 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -80.62 120.6 24.77 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -92.34 151.24 41.3 Favored Pre-proline 0 C--N 1.349 0.554 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -63.82 141.95 80.53 Favored 'Trans proline' 0 CA--C 1.517 -0.344 0 C-N-CA 121.721 1.614 . . . . 0.0 113.398 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.26 -37.64 94.9 Favored Glycine 0 C--N 1.357 1.743 0 O-C-N 121.862 -0.524 . . . . 0.0 112.449 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.47 -29.75 66.39 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 118.535 1.168 . . . . 0.0 109.887 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -36.45 64.96 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -69.71 -26.1 64.18 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.022 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.39 -48.54 80.76 Favored 'General case' 0 C--N 1.356 0.858 0 CA-C-O 122.133 0.968 . . . . 0.0 109.39 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -67.36 -42.18 83.9 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.287 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.5 -40.98 80.68 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.91 -0.494 . . . . 0.0 111.065 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 60.4 tp -67.08 -40.42 87.01 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 95.69 41.02 3.98 Favored Glycine 0 C--N 1.361 1.933 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -100.53 115.51 30.3 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -86.9 95.88 10.04 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 12.0 t . . . . . 0 C--O 1.264 1.859 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.643 179.084 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 N--CA 1.504 2.234 0 CA-C-O 121.459 0.647 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -141.93 161.87 36.9 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 121.334 -0.854 . . . . 0.0 108.969 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.3 pt -64.37 -21.29 28.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 123.546 0.738 . . . . 0.0 112.719 -178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -76.08 -8.6 57.37 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 121.131 -0.981 . . . . 0.0 111.165 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.39 -4.0 49.22 Favored 'General case' 0 C--N 1.357 0.915 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.6 mt -105.96 -112.93 0.26 Allowed 'General case' 0 C--N 1.349 0.553 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.707 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -90.01 158.3 44.57 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.707 ' HD2' HG22 ' A' ' 7' ' ' VAL . 82.3 Cg_exo -54.92 128.87 32.36 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 120.813 1.009 . . . . 0.0 112.288 176.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.93 117.59 16.94 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 123.161 1.457 . . . . 0.0 112.245 -175.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -85.68 161.45 50.71 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 113.409 -1.723 . . . . 0.0 106.986 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.7 -24.57 63.77 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.49 2.127 . . . . 0.0 113.432 177.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -74.07 -52.76 11.65 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.581 1.153 . . . . 0.0 107.961 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.61 -46.23 81.02 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.287 1.435 . . . . 0.0 110.764 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.6 t -61.0 -42.71 94.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -71.26 -36.01 71.59 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.303 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.78 -40.82 75.82 Favored 'General case' 0 C--N 1.369 1.433 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -75.33 -19.4 59.64 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.914 -0.491 . . . . 0.0 112.127 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.4 m -60.55 -54.99 49.38 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -177.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -76.08 151.94 35.32 Favored 'Trans proline' 0 CA--C 1.512 -0.59 0 CA-C-N 121.576 1.599 . . . . 0.0 114.224 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.404 ' CD2' HD22 ' A' ' 30' ' ' LEU . 11.1 m-85 -125.85 148.4 49.17 Favored 'General case' 0 C--N 1.353 0.748 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -87.39 62.93 7.45 Favored 'General case' 0 C--N 1.356 0.877 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 32.3 t -162.46 154.92 19.24 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -69.0 -37.15 78.55 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -150.3 152.34 34.33 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 75.01 175.74 0.24 Allowed 'General case' 0 C--N 1.37 1.464 0 CA-C-O 122.004 0.907 . . . . 0.0 110.106 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 76.5 mtm180 -88.1 146.74 25.28 Favored 'General case' 0 C--N 1.354 0.781 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.449 ' HG3' ' H ' ' A' ' 29' ' ' TYR . 31.7 tpt180 -95.65 145.63 25.11 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -58.92 -23.16 60.94 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.449 ' H ' ' HG3' ' A' ' 27' ' ' ARG . 24.8 m-85 -78.77 -13.79 59.62 Favored 'General case' 0 C--N 1.359 1.001 0 O-C-N 120.672 -1.267 . . . . 0.0 110.812 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.404 HD22 ' CD2' ' A' ' 20' ' ' TYR . 55.4 tp -66.39 -55.03 21.2 Favored Pre-proline 0 C--N 1.367 1.351 0 O-C-N 121.283 -0.885 . . . . 0.0 112.345 -178.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -64.95 -20.25 64.14 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 120.804 1.323 . . . . 0.0 114.713 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -73.19 -29.47 62.85 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.43 -17.93 57.67 Favored 'General case' 0 C--N 1.365 1.259 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.29 -36.09 80.82 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.3 t -63.69 -38.08 89.76 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.601 HD23 HD11 ' A' ' 42' ' ' ILE . 7.1 mp -68.67 -45.23 72.26 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -57.93 -37.71 74.6 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 124.65 1.18 . . . . 0.0 112.583 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.69 -10.23 25.59 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 121.305 -0.872 . . . . 0.0 112.529 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 125.39 2.49 7.56 Favored Glycine 0 C--N 1.374 2.663 0 CA-C-N 119.466 1.03 . . . . 0.0 111.889 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.0 t -68.24 -46.0 71.7 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-N 119.259 1.529 . . . . 0.0 109.828 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.31 -178.34 0.15 Allowed 'General case' 0 C--N 1.371 1.517 0 CA-C-O 121.301 0.572 . . . . 0.0 110.75 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.601 HD11 HD23 ' A' ' 36' ' ' LEU . 1.7 mp -140.6 125.92 19.6 Favored 'Isoleucine or valine' 0 C--N 1.363 1.191 0 CA-C-O 122.511 1.148 . . . . 0.0 108.453 179.025 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -154.03 125.71 7.63 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.41 -170.24 42.21 Favored Glycine 0 CA--C 1.492 -1.374 0 N-CA-C 108.456 -1.858 . . . . 0.0 108.456 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -119.13 112.66 19.8 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.3 tpt180 -95.66 132.49 40.79 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.04 129.8 37.4 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.959 1.362 . . . . 0.0 110.32 -178.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.1 t -114.0 119.34 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 104.177 -2.527 . . . . 0.0 104.177 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -72.61 135.95 45.62 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.419 0.628 . . . . 0.0 109.333 -178.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.41 -5.3 57.19 Favored Glycine 0 C--N 1.36 1.879 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.77 -103.5 0.38 Allowed Glycine 0 C--N 1.355 1.616 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.429 ' HB1' ' HD2' ' A' ' 53' ' ' PRO . . . -162.56 162.24 19.24 Favored Pre-proline 0 N--CA 1.447 -0.576 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -177.051 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.429 ' HD2' ' HB1' ' A' ' 52' ' ' ALA . 70.5 Cg_endo -72.62 127.18 12.15 Favored 'Trans proline' 0 CA--C 1.514 -0.481 0 C-N-CA 121.161 1.24 . . . . 0.0 113.527 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 pt -110.19 137.75 41.1 Favored 'Isoleucine or valine' 0 C--N 1.358 0.963 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.9 m -64.34 140.57 58.88 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.133 0.968 . . . . 0.0 112.002 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -140.71 143.59 35.11 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -129.75 131.43 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.475 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -138.05 130.25 28.89 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.8 p -127.74 154.84 44.89 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-O 122.383 1.087 . . . . 0.0 109.55 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.02 132.13 46.11 Favored 'General case' 0 C--N 1.355 0.833 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.9 m -155.13 148.57 25.11 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 103.396 -2.816 . . . . 0.0 103.396 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.8 m -71.26 100.01 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 122.754 1.264 . . . . 0.0 110.134 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.1 p -100.63 163.75 17.52 Favored Pre-proline 0 C--N 1.356 0.877 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -53.29 154.66 13.97 Favored 'Trans proline' 0 C--O 1.208 -1.015 0 C-N-CA 122.037 1.825 . . . . 0.0 115.286 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 54.8 tp -50.03 -50.62 67.93 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -177.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -73.04 -8.35 22.05 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.193 1.462 . . . . 0.0 112.339 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.22 24.38 11.2 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.249 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.23 70.41 2.86 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-O 122.241 1.02 . . . . 0.0 108.26 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.6 mtt -120.35 154.35 35.19 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 122.006 0.908 . . . . 0.0 110.068 -177.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 58.8 m -95.33 133.96 38.66 Favored 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.038 -2.208 . . . . 0.0 105.038 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -112.4 130.81 55.84 Favored 'General case' 0 C--N 1.359 1.016 0 CA-C-N 122.251 2.296 . . . . 0.0 109.318 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.3 t -126.08 135.82 52.18 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -115.4 124.3 50.85 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mt -126.01 125.32 42.47 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -101.78 137.59 39.89 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -86.11 113.81 22.47 Favored 'General case' 0 C--N 1.348 0.518 0 O-C-N 121.344 -0.847 . . . . 0.0 109.127 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 41.3 t30 63.89 26.29 14.22 Favored 'General case' 0 C--N 1.372 1.573 0 C-N-CA 123.475 0.71 . . . . 0.0 110.303 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 64.28 25.07 13.47 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 123.397 0.679 . . . . 0.0 111.003 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -94.8 122.52 37.51 Favored 'General case' 0 C--N 1.355 0.816 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.6 -35.65 78.46 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -70.47 -17.35 62.98 Favored 'General case' 0 C--N 1.358 0.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.523 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.9 mt -111.99 84.09 1.9 Allowed 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -122.65 131.73 53.94 Favored 'General case' 0 C--N 1.362 1.139 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -108.75 130.74 55.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -119.43 107.83 13.81 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -121.58 119.4 58.82 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.22 140.75 45.52 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -151.66 160.44 31.7 Favored Pre-proline 0 C--O 1.24 0.589 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.41 149.46 23.23 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 122.323 2.015 . . . . 0.0 111.709 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -61.84 -19.91 63.1 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 120.562 -1.336 . . . . 0.0 113.839 -174.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 49.9 p-80 -89.18 -24.52 22.14 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.34 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.01 -29.08 15.41 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.975 -0.453 . . . . 0.0 111.181 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -63.42 -38.09 89.79 Favored 'General case' 0 C--N 1.36 1.039 0 O-C-N 121.838 -0.538 . . . . 0.0 111.566 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.401 ' O ' HG13 ' A' ' 98' ' ' ILE . 9.2 mp -66.28 -32.58 74.07 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.652 -1.28 . . . . 0.0 109.622 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -59.21 -42.45 91.0 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 120.225 1.375 . . . . 0.0 108.974 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -63.04 -48.68 77.7 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.916 0.886 . . . . 0.0 109.994 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.26 -43.14 99.37 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 94' ' ' LEU . 0.5 OUTLIER -63.84 -44.54 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 O-C-N 121.244 -0.91 . . . . 0.0 109.753 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.75 -40.14 96.31 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.54 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttm -62.49 -50.74 70.22 Favored 'General case' 0 C--N 1.358 0.944 0 C-N-CA 122.366 0.266 . . . . 0.0 110.586 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.57 -44.17 96.98 Favored 'General case' 0 C--N 1.362 1.111 0 CA-C-O 121.546 0.689 . . . . 0.0 109.923 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 60.1 ttm -62.24 -49.02 77.41 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.479 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.41 -49.45 73.93 Favored Glycine 0 C--N 1.359 1.837 0 CA-C-O 118.952 -0.916 . . . . 0.0 115.285 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -85.89 -33.13 21.32 Favored 'General case' 0 C--N 1.363 1.19 0 CA-C-N 120.175 1.987 . . . . 0.0 113.107 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -80.85 -50.22 10.08 Favored 'General case' 0 C--N 1.354 0.786 0 O-C-N 120.449 -1.407 . . . . 0.0 111.392 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -63.82 -43.9 94.85 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -177.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.0 mtp -88.41 -17.17 31.04 Favored 'General case' 0 C--N 1.363 1.167 0 O-C-N 121.164 -0.96 . . . . 0.0 110.783 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 62.18 42.58 9.42 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-O 122.459 1.123 . . . . 0.0 110.74 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.17 144.34 45.79 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.3 -1.318 . . . . 0.0 107.895 179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 24.1 p -89.09 -14.21 36.81 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 121.112 0.482 . . . . 0.0 109.708 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -98.85 127.14 44.7 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -85.02 162.36 49.72 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -59.15 148.1 87.41 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 121.568 1.512 . . . . 0.0 113.05 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -37.45 92.13 Favored Glycine 0 C--N 1.359 1.833 0 O-C-N 121.735 -0.603 . . . . 0.0 112.869 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.45 -26.38 63.62 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 118.798 1.299 . . . . 0.0 109.955 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -75.51 -30.78 59.92 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -73.07 -17.21 61.44 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 121.42 -0.8 . . . . 0.0 110.541 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -67.61 -42.58 82.18 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-O 122.761 1.267 . . . . 0.0 107.634 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -64.03 -41.09 97.53 Favored 'General case' 0 C--N 1.357 0.903 0 CA-C-N 113.188 -1.824 . . . . 0.0 110.814 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.4 mp -71.25 -40.02 71.26 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 122.086 -0.383 . . . . 0.0 110.294 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.8 tp -67.9 -39.72 83.56 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 122.729 0.412 . . . . 0.0 109.951 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 103.24 30.97 5.17 Favored Glycine 0 C--N 1.361 1.955 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -103.41 114.97 29.66 Favored 'General case' 0 C--N 1.355 0.806 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -91.89 97.29 10.88 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.268 2.067 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.71 179.331 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ttt . . . . . 0 N--CA 1.505 2.304 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -119.32 145.05 46.49 Favored 'General case' 0 C--N 1.361 1.095 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.9 pt -59.35 -19.71 16.79 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -79.39 -2.98 44.24 Favored 'General case' 0 C--N 1.365 1.264 0 CA-C-N 120.208 1.367 . . . . 0.0 110.571 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.27 -5.29 44.01 Favored 'General case' 0 C--N 1.357 0.916 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -107.1 -112.26 0.29 Allowed 'General case' 0 C--N 1.353 0.751 0 CA-C-O 121.98 0.895 . . . . 0.0 108.778 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.714 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.0 158.3 44.59 Favored Pre-proline 0 C--N 1.345 0.389 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.714 ' HD2' HG22 ' A' ' 7' ' ' VAL . 81.5 Cg_exo -55.12 128.21 29.58 Favored 'Trans proline' 0 N--CA 1.478 0.577 0 CA-C-N 119.842 0.979 . . . . 0.0 112.257 176.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.06 117.79 18.98 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 123.119 1.437 . . . . 0.0 112.326 -175.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -85.64 160.78 52.65 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 113.487 -1.688 . . . . 0.0 106.933 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.5 -25.28 65.84 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.441 2.094 . . . . 0.0 113.513 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -74.86 -50.95 15.23 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -46.06 80.09 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 125.201 1.401 . . . . 0.0 110.586 177.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.1 t -61.24 -43.52 96.63 Favored 'Isoleucine or valine' 0 C--N 1.348 0.539 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.866 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.7 m -73.01 -34.49 66.41 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.79 -176.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -71.98 -41.04 68.15 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 121.36 -0.838 . . . . 0.0 110.26 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -70.44 -34.71 72.78 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.2 m -49.65 -51.61 58.09 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -176.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -81.93 125.61 4.83 Favored 'Trans proline' 0 CA--C 1.516 -0.407 0 CA-C-N 121.788 1.674 . . . . 0.0 113.196 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -150.19 160.69 43.49 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.662 -1.607 . . . . 0.0 106.662 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -96.02 146.11 24.9 Favored 'General case' 0 C--N 1.35 0.616 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.6 m -161.52 71.38 0.38 Allowed 'General case' 0 C--N 1.353 0.753 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -70.61 -40.38 73.23 Favored 'General case' 0 C--N 1.361 1.081 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -160.56 145.72 14.58 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 60.52 -121.76 0.93 Allowed 'General case' 0 C--N 1.366 1.307 0 C-N-CA 122.853 0.461 . . . . 0.0 110.023 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 91.0 mmt-85 -136.41 146.36 46.33 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -96.32 126.03 41.24 Favored 'General case' 0 C--N 1.357 0.921 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -65.67 -18.56 65.42 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.906 -179.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -66.56 -38.63 87.51 Favored 'General case' 0 C--N 1.348 0.535 0 O-C-N 121.906 -0.496 . . . . 0.0 111.83 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.73 -56.66 27.29 Favored Pre-proline 0 C--N 1.364 1.207 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.71 -19.31 36.55 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 120.94 1.371 . . . . 0.0 114.667 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -70.59 -37.84 73.95 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.31 -27.48 60.73 Favored 'General case' 0 C--N 1.366 1.285 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.03 -38.18 85.46 Favored 'General case' 0 C--N 1.365 1.26 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.6 m -65.4 -39.81 92.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.125 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.927 HD13 HD11 ' A' ' 42' ' ' ILE . 72.4 mt -69.07 -39.46 79.08 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 121.486 -0.759 . . . . 0.0 110.136 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -53.76 -27.05 26.41 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 125.355 1.462 . . . . 0.0 112.823 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -64.34 -11.97 37.61 Favored 'General case' 0 C--N 1.363 1.192 0 O-C-N 121.133 -0.979 . . . . 0.0 112.505 -178.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.78 -0.33 10.98 Favored Glycine 0 C--N 1.371 2.499 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.6 m -69.7 -41.65 75.13 Favored 'General case' 0 C--N 1.358 0.936 0 CA-C-N 118.241 1.021 . . . . 0.0 109.647 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 66.18 -178.89 0.2 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.558 0.695 . . . . 0.0 110.852 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.927 HD11 HD13 ' A' ' 36' ' ' LEU . 2.6 mp -135.79 124.88 39.7 Favored 'Isoleucine or valine' 0 C--N 1.358 0.975 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -150.06 126.65 10.91 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 103.193 -2.892 . . . . 0.0 103.193 178.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 179.17 -171.02 42.93 Favored Glycine 0 CA--C 1.492 -1.371 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -121.3 115.32 22.76 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 tpt180 -91.91 130.31 37.7 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.82 116.38 20.78 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.829 1.299 . . . . 0.0 110.478 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.472 HG13 ' HB3' ' A' ' 104' ' ' TYR . 91.5 t -96.91 109.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 N-CA-C 104.426 -2.435 . . . . 0.0 104.426 176.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -70.49 131.08 43.49 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.78 58.35 Favored Glycine 0 C--N 1.359 1.814 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -134.77 -107.88 0.96 Allowed Glycine 0 C--N 1.356 1.654 0 N-CA-C 108.604 -1.799 . . . . 0.0 108.604 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.57 158.38 25.04 Favored Pre-proline 0 N--CA 1.445 -0.699 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -178.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.58 121.62 6.46 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.179 1.253 . . . . 0.0 112.963 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 3.6 pt -108.31 136.05 45.12 Favored 'Isoleucine or valine' 0 C--N 1.358 0.978 0 CA-C-O 122.217 1.008 . . . . 0.0 108.709 -178.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.0 m -65.28 141.45 58.6 Favored 'General case' 0 C--N 1.364 1.196 0 CA-C-O 122.186 0.993 . . . . 0.0 112.099 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -141.19 145.29 35.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -129.71 130.61 66.84 Favored 'Isoleucine or valine' 0 C--N 1.351 0.664 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.56 136.06 35.65 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.2 t -135.09 152.62 51.83 Favored 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.324 1.059 . . . . 0.0 109.562 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -123.72 114.76 20.37 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 66.4 p -140.3 161.15 38.36 Favored 'General case' 0 CA--C 1.497 -1.093 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -79.6 101.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 CA-C-O 122.377 1.084 . . . . 0.0 109.835 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -99.45 161.77 23.47 Favored Pre-proline 0 C--N 1.355 0.821 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_exo -53.64 156.47 11.57 Favored 'Trans proline' 0 C--O 1.207 -1.067 0 C-N-CA 122.145 1.896 . . . . 0.0 115.772 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.8 tp -49.24 -53.54 38.38 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -73.73 -6.42 18.62 Favored 'Trans proline' 0 C--N 1.353 0.799 0 CA-C-N 121.226 1.474 . . . . 0.0 112.636 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -116.97 25.15 10.71 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.71 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 68.96 2.4 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-O 122.195 0.997 . . . . 0.0 108.555 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 59.1 mtt -125.46 152.82 44.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.925 -177.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -90.82 134.05 34.74 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -110.55 131.09 55.35 Favored 'General case' 0 C--N 1.36 1.031 0 CA-C-N 122.063 2.211 . . . . 0.0 109.726 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.1 t -124.96 136.66 53.95 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.6 123.86 49.5 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.0 131.59 52.19 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -178.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -101.71 140.42 36.02 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.119 -1.438 . . . . 0.0 107.119 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -85.86 110.7 19.58 Favored 'General case' 0 C--N 1.348 0.52 0 O-C-N 121.356 -0.84 . . . . 0.0 109.077 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.41 26.43 15.76 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 123.702 0.801 . . . . 0.0 110.595 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 67.41 21.77 9.59 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 123.604 0.762 . . . . 0.0 110.959 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -91.28 114.94 27.61 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.49 -24.71 67.62 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -74.6 -15.85 60.82 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.372 -0.83 . . . . 0.0 109.337 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.2 mt -116.04 87.49 2.69 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.4 m -120.94 130.65 53.94 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -109.11 133.15 53.38 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.64 108.76 15.33 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 103.388 -2.819 . . . . 0.0 103.388 177.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 118.67 57.41 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 -176.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.99 141.79 46.31 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -151.04 159.06 34.34 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -52.26 149.62 21.91 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 C-N-CA 122.398 2.066 . . . . 0.0 111.973 176.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.22 -19.38 54.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.784 -1.198 . . . . 0.0 113.538 -174.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -89.8 -23.74 21.65 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.306 -0.871 . . . . 0.0 109.787 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -94.39 -30.45 14.48 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 123.054 0.541 . . . . 0.0 111.357 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.82 -39.27 93.78 Favored 'General case' 0 C--N 1.361 1.1 0 O-C-N 121.901 -0.499 . . . . 0.0 112.204 -176.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.92 -32.92 74.87 Favored 'General case' 0 C--O 1.205 -1.245 0 O-C-N 120.617 -1.302 . . . . 0.0 110.12 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.21 -41.69 89.17 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 119.952 1.251 . . . . 0.0 109.26 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -62.29 -48.21 80.88 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.81 0.844 . . . . 0.0 109.765 175.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.6 -42.57 99.06 Favored 'General case' 0 C--N 1.359 1.011 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.89 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -64.14 -43.22 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 O-C-N 121.337 -0.852 . . . . 0.0 109.519 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.03 -40.3 95.27 Favored 'General case' 0 C--N 1.363 1.163 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 45.5 ttm -62.85 -49.34 75.27 Favored 'General case' 0 C--N 1.356 0.89 0 CA-C-O 120.884 0.374 . . . . 0.0 111.01 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.23 -45.96 82.56 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 121.457 0.646 . . . . 0.0 109.978 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.4 ttm -62.65 -49.83 73.59 Favored 'General case' 0 C--O 1.217 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.553 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.67 -45.17 96.35 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 121.333 -0.855 . . . . 0.0 113.962 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.472 ' HB3' HG13 ' A' ' 48' ' ' VAL . 59.9 m-85 -86.82 -37.8 17.44 Favored 'General case' 0 C--N 1.358 0.947 0 CA-C-N 119.436 1.618 . . . . 0.0 113.008 -176.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -81.37 -50.7 9.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 120.507 -1.37 . . . . 0.0 111.877 -176.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -64.87 -42.58 94.72 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.4 mtp -84.01 -22.44 31.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.886 -1.134 . . . . 0.0 110.803 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 59.91 37.81 21.4 Favored 'General case' 0 C--N 1.369 1.425 0 CA-C-O 122.255 1.026 . . . . 0.0 110.921 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -127.83 145.88 50.79 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.591 -1.186 . . . . 0.0 108.405 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.1 t -89.06 -4.35 58.39 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.62 107.92 16.38 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -85.39 151.75 56.77 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.19 140.16 76.26 Favored 'Trans proline' 0 N--CA 1.472 0.256 0 C-N-CA 121.544 1.496 . . . . 0.0 113.37 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -37.08 93.54 Favored Glycine 0 C--N 1.357 1.725 0 O-C-N 121.88 -0.513 . . . . 0.0 112.417 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.73 -29.55 65.84 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.508 1.154 . . . . 0.0 109.69 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -72.78 -37.75 67.51 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -71.35 -24.75 62.16 Favored 'General case' 0 C--N 1.367 1.344 0 O-C-N 121.818 -0.551 . . . . 0.0 110.401 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.23 -46.5 90.17 Favored 'General case' 0 C--N 1.359 0.979 0 CA-C-O 121.953 0.882 . . . . 0.0 109.501 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -65.59 -39.58 91.73 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.748 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -43.67 77.64 Favored 'General case' 0 C--N 1.363 1.183 0 O-C-N 121.799 -0.563 . . . . 0.0 110.575 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.88 -41.25 83.08 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 122.766 0.426 . . . . 0.0 110.094 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 90.72 42.19 5.16 Favored Glycine 0 C--N 1.361 1.929 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -102.16 115.11 29.86 Favored 'General case' 0 C--N 1.352 0.698 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -89.58 96.39 10.68 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 24.2 t . . . . . 0 C--O 1.267 2.004 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.293 178.391 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.7 tpt . . . . . 0 N--CA 1.503 2.181 0 CA-C-O 121.713 0.768 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -109.12 137.02 47.66 Favored 'General case' 0 C--N 1.359 1.005 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.2 tt -57.15 -24.68 21.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.352 0 C-N-CA 123.864 0.866 . . . . 0.0 112.648 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.29 -15.14 63.45 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 121.67 -0.643 . . . . 0.0 110.739 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -89.4 -5.68 57.23 Favored 'General case' 0 C--N 1.361 1.083 0 O-C-N 121.623 -0.673 . . . . 0.0 109.555 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -101.67 -104.14 0.26 Allowed 'General case' 0 C--N 1.35 0.609 0 CA-C-O 122.089 0.947 . . . . 0.0 109.108 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.591 HG22 ' HD2' ' A' ' 8' ' ' PRO . 3.3 p -89.93 153.99 47.44 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.591 ' HD2' HG22 ' A' ' 7' ' ' VAL . 71.5 Cg_exo -56.78 126.56 22.64 Favored 'Trans proline' 0 C--N 1.349 0.584 0 CA-C-N 119.635 0.905 . . . . 0.0 111.259 175.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.26 119.05 24.09 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.399 1.571 . . . . 0.0 112.563 -175.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -84.1 164.79 42.26 Favored Pre-proline 0 N--CA 1.439 -0.99 0 CA-C-N 112.954 -1.93 . . . . 0.0 106.036 175.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -55.52 -26.94 57.01 Favored 'Trans proline' 0 N--CA 1.486 1.066 0 C-N-CA 122.133 1.888 . . . . 0.0 113.031 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.65 -51.07 25.02 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 124.498 1.119 . . . . 0.0 108.954 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.36 81.58 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.031 1.332 . . . . 0.0 111.04 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 45.6 t -61.26 -44.03 97.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.049 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 67.5 m -72.42 -36.66 68.64 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.919 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.57 -41.04 69.53 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 121.522 -0.736 . . . . 0.0 110.68 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.429 ' CD1' HD21 ' A' ' 34' ' ' LEU . 72.9 t80 -66.23 -36.07 82.08 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.0 m -52.58 -54.76 39.18 Favored Pre-proline 0 N--CA 1.487 1.424 0 N-CA-C 114.714 1.375 . . . . 0.0 114.714 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -76.98 157.86 34.45 Favored 'Trans proline' 0 CA--C 1.516 -0.419 0 CA-C-N 121.486 1.567 . . . . 0.0 114.542 179.212 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -153.27 160.7 42.8 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -147.32 138.01 23.51 Favored 'General case' 0 C--N 1.352 0.68 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.8 t -157.98 151.79 23.9 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -101.34 12.38 37.54 Favored 'General case' 0 C--N 1.356 0.878 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.96 167.22 22.71 Favored 'General case' 0 C--N 1.352 0.679 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -81.93 58.15 3.77 Favored 'General case' 0 C--N 1.359 1.016 0 O-C-N 121.489 -0.757 . . . . 0.0 110.082 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -159.54 131.85 6.55 Favored 'General case' 0 C--N 1.35 0.604 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -86.45 64.81 8.74 Favored 'General case' 0 C--N 1.357 0.893 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.5 tpt180 -64.72 -43.98 91.66 Favored 'General case' 0 C--N 1.356 0.863 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -74.73 -22.07 59.01 Favored 'General case' 0 C--N 1.359 1.002 0 O-C-N 121.208 -0.932 . . . . 0.0 113.216 -177.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.43 -56.11 38.53 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.13 -18.12 24.05 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 CA-C-N 121.201 1.465 . . . . 0.0 114.508 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -70.17 -37.26 75.12 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.32 -24.22 57.38 Favored 'General case' 0 C--N 1.359 1.015 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.69 -178.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.429 HD21 ' CD1' ' A' ' 17' ' ' TYR . 94.0 mt -66.83 -38.58 86.7 Favored 'General case' 0 C--N 1.363 1.172 0 O-C-N 121.558 -0.714 . . . . 0.0 109.846 179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.0 t -65.77 -41.12 92.43 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.852 HD13 HD11 ' A' ' 42' ' ' ILE . 80.2 mt -64.59 -39.95 94.65 Favored 'General case' 0 C--N 1.36 1.054 0 O-C-N 121.499 -0.751 . . . . 0.0 109.446 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.62 -21.04 15.83 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.146 1.378 . . . . 0.0 112.647 178.133 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -70.13 -17.55 63.2 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.262 -0.899 . . . . 0.0 111.014 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.97 5.2 7.59 Favored Glycine 0 C--N 1.359 1.827 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.9 t -69.29 -44.09 72.51 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.272 1.036 . . . . 0.0 109.099 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 67.79 178.27 0.24 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.591 0.71 . . . . 0.0 110.54 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.852 HD11 HD13 ' A' ' 36' ' ' LEU . 2.6 mp -135.08 123.11 39.18 Favored 'Isoleucine or valine' 0 C--N 1.358 0.954 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -150.42 126.67 10.66 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 103.272 -2.862 . . . . 0.0 103.272 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.65 -168.91 40.2 Favored Glycine 0 CA--C 1.493 -1.335 0 N-CA-C 108.292 -1.923 . . . . 0.0 108.292 -178.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.6 p -121.45 114.51 21.37 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.52 134.27 35.13 Favored 'General case' 0 C--N 1.355 0.839 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 118.62 24.12 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.746 1.26 . . . . 0.0 110.326 -176.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.498 HG13 ' HB3' ' A' ' 104' ' ' TYR . 87.2 t -98.9 108.67 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 104.281 -2.489 . . . . 0.0 104.281 176.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -68.9 129.75 40.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 101.74 -8.59 56.42 Favored Glycine 0 C--N 1.361 1.918 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -133.91 -107.45 0.98 Allowed Glycine 0 C--N 1.355 1.601 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.59 158.6 25.28 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 124.38 8.3 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.178 1.252 . . . . 0.0 113.035 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.8 pt -111.12 139.72 33.75 Favored 'Isoleucine or valine' 0 C--N 1.356 0.866 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.4 p -65.9 144.9 56.51 Favored 'General case' 0 C--N 1.365 1.281 0 CA-C-O 121.746 0.784 . . . . 0.0 111.974 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -142.65 143.62 32.43 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.5 t -129.56 129.61 66.81 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.09 133.87 32.15 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -132.26 151.58 51.76 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 122.445 1.117 . . . . 0.0 108.754 -178.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -119.29 124.26 46.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 105.58 -2.008 . . . . 0.0 105.58 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.6 m -155.91 144.64 20.34 Favored 'General case' 0 CA--C 1.493 -1.212 0 N-CA-C 103.933 -2.618 . . . . 0.0 103.933 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 62' ' ' VAL . 0.7 OUTLIER -69.57 100.97 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-O 122.432 1.111 . . . . 0.0 110.86 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.76 156.95 34.58 Favored Pre-proline 0 C--N 1.352 0.674 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.69 152.33 1.67 Allowed 'Trans proline' 0 C--O 1.204 -1.216 0 C-N-CA 122.907 2.405 . . . . 0.0 117.029 -177.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.33 -50.9 73.49 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -176.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.07 -5.02 16.27 Favored 'Trans proline' 0 CA--C 1.511 -0.65 0 CA-C-N 121.036 1.406 . . . . 0.0 112.123 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.81 24.65 10.91 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -70.48 68.87 0.38 Allowed 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.557 0.694 . . . . 0.0 110.323 -178.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.1 mtt -124.39 153.93 41.15 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.826 0.822 . . . . 0.0 109.607 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.7 m -94.33 135.61 35.54 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 mtt85 -115.64 129.61 56.56 Favored 'General case' 0 C--N 1.361 1.079 0 CA-C-N 122.167 2.258 . . . . 0.0 109.64 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.4 t -123.33 141.23 52.2 Favored 'General case' 0 C--N 1.353 0.725 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -120.12 124.18 45.17 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -126.33 133.65 51.31 Favored 'General case' 0 C--N 1.355 0.838 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -103.88 139.56 38.89 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -86.24 112.52 21.45 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.662 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.66 25.31 15.05 Favored 'General case' 0 C--N 1.374 1.645 0 C-N-CA 123.717 0.807 . . . . 0.0 110.369 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 66.17 23.82 10.89 Favored 'General case' 0 C--N 1.371 1.509 0 C-N-CA 123.578 0.751 . . . . 0.0 110.693 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -93.44 118.17 30.99 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -18.3 65.23 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -85.59 -4.53 59.19 Favored 'General case' 0 C--N 1.357 0.934 0 O-C-N 121.211 -0.931 . . . . 0.0 109.58 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.06 95.33 4.27 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.3 p -126.05 149.6 48.75 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-O 122.115 0.959 . . . . 0.0 109.353 -176.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -126.42 132.24 51.55 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -120.82 108.29 13.76 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 103.194 -2.891 . . . . 0.0 103.194 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mm -120.51 118.93 58.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.097 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.32 142.21 45.77 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.12 159.75 33.12 Favored Pre-proline 0 C--O 1.239 0.541 0 N-CA-C 105.631 -1.988 . . . . 0.0 105.631 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -52.19 149.26 22.41 Favored 'Trans proline' 0 N--CA 1.484 0.953 0 C-N-CA 122.343 2.028 . . . . 0.0 111.502 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.21 -18.67 59.44 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.633 -1.292 . . . . 0.0 113.727 -174.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -89.7 -22.9 22.0 Favored 'General case' 0 C--N 1.355 0.822 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -94.61 -29.67 14.74 Favored 'General case' 0 C--N 1.357 0.933 0 O-C-N 121.784 -0.573 . . . . 0.0 111.134 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -64.61 -40.79 96.13 Favored 'General case' 0 C--N 1.361 1.082 0 O-C-N 121.944 -0.473 . . . . 0.0 111.857 -176.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.76 -32.83 74.6 Favored 'General case' 0 C--O 1.207 -1.183 0 O-C-N 120.461 -1.4 . . . . 0.0 110.101 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -59.52 -41.31 89.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.136 1.334 . . . . 0.0 108.893 177.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' TYR . . . . . 0.475 ' HE1' HD11 ' A' ' 120' ' ' LEU . 12.5 t80 -63.2 -48.18 79.44 Favored 'General case' 0 C--N 1.351 0.671 0 C-N-CA 123.622 0.769 . . . . 0.0 110.011 175.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -42.48 96.37 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.607 0.363 . . . . 0.0 111.595 -176.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.88 -44.7 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 121.485 -0.759 . . . . 0.0 109.62 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.63 -40.86 96.35 Favored 'General case' 0 C--N 1.363 1.193 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -63.03 -49.21 75.49 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.718 0.407 . . . . 0.0 110.913 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.01 -46.41 78.05 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-O 121.631 0.729 . . . . 0.0 110.247 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttm -62.45 -49.92 73.52 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.942 -178.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.2 -44.29 97.92 Favored Glycine 0 C--N 1.358 1.79 0 CA-C-O 119.371 -0.683 . . . . 0.0 114.11 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' TYR . . . . . 0.498 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.9 m-85 -85.49 -38.13 18.92 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.387 1.594 . . . . 0.0 112.34 -176.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -78.39 -50.09 12.36 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 120.647 -1.283 . . . . 0.0 111.975 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -66.24 -42.34 88.75 Favored 'General case' 0 C--N 1.357 0.896 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 86.8 mtp -86.33 -22.55 26.64 Favored 'General case' 0 C--N 1.367 1.337 0 O-C-N 120.743 -1.223 . . . . 0.0 110.703 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 62.61 32.51 16.31 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-O 122.067 0.937 . . . . 0.0 111.148 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -114.41 141.74 47.27 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.3 t -86.7 -9.05 56.81 Favored 'General case' 0 C--N 1.362 1.144 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -88.41 121.99 31.42 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -87.76 153.31 52.42 Favored Pre-proline 0 C--N 1.348 0.537 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -63.17 142.1 85.46 Favored 'Trans proline' 0 CA--C 1.519 -0.249 0 C-N-CA 121.611 1.541 . . . . 0.0 113.18 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.89 -38.28 95.74 Favored Glycine 0 C--N 1.357 1.701 0 O-C-N 121.82 -0.55 . . . . 0.0 112.585 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.65 -28.6 63.87 Favored 'General case' 0 C--N 1.36 1.043 0 CA-C-N 118.723 1.262 . . . . 0.0 109.652 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -72.65 -34.11 67.04 Favored 'General case' 0 C--N 1.356 0.881 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -73.56 -24.24 60.07 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 121.194 -0.941 . . . . 0.0 110.378 -179.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -61.98 -49.94 74.08 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-O 121.378 0.608 . . . . 0.0 111.314 -178.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.05 -23.96 63.18 Favored 'General case' 0 C--N 1.363 1.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.065 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.475 HD11 ' HE1' ' A' ' 96' ' ' TYR . 5.2 mp -84.04 -42.19 16.42 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.571 -0.706 . . . . 0.0 109.33 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.0 tp -68.21 -40.45 82.14 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 88.25 21.44 45.19 Favored Glycine 0 C--N 1.366 2.226 0 N-CA-C 110.236 -1.146 . . . . 0.0 110.236 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -97.08 115.85 28.23 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -84.98 96.47 9.39 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 79.2 p . . . . . 0 C--O 1.264 1.841 0 CA-C-O 117.357 -1.306 . . . . 0.0 111.045 179.905 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 . . . . . 0 CA--C 1.515 -0.386 0 CA-C-O 121.992 0.901 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.76 -19.41 25.36 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.796 -178.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -72.95 -11.08 60.44 Favored 'General case' 0 C--N 1.362 1.143 0 O-C-N 121.139 -0.976 . . . . 0.0 110.671 -178.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -93.15 -6.41 47.95 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.5 mt -103.87 -114.58 0.23 Allowed 'General case' 0 C--N 1.353 0.722 0 CA-C-O 121.942 0.877 . . . . 0.0 109.102 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.723 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -89.52 158.05 46.24 Favored Pre-proline 0 C--N 1.345 0.39 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.723 ' HD2' HG22 ' A' ' 7' ' ' VAL . 85.3 Cg_exo -54.82 129.0 32.81 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 120.795 0.996 . . . . 0.0 112.181 176.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.92 117.0 14.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-O 123.415 1.579 . . . . 0.0 112.631 -175.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -85.8 160.91 51.92 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -60.42 -23.6 75.33 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 121.467 1.445 . . . . 0.0 113.01 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -73.12 -47.87 40.52 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-O 122.392 1.091 . . . . 0.0 108.601 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.35 93.32 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 125.07 1.348 . . . . 0.0 110.778 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.8 t -61.56 -44.36 98.5 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.962 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.2 p -73.21 -33.42 65.36 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 119.076 -1.05 . . . . 0.0 111.671 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.44 -38.93 71.29 Favored 'General case' 0 C--N 1.361 1.07 0 O-C-N 121.272 -0.893 . . . . 0.0 110.285 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.465 ' CD1' HD21 ' A' ' 34' ' ' LEU . 71.3 t80 -79.54 -13.64 59.4 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 121.921 -0.487 . . . . 0.0 111.742 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 17.5 m -59.19 -51.81 79.02 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 120.636 -1.29 . . . . 0.0 114.121 -177.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo . . . . . 0 C--N 1.349 0.572 0 CA-C-N 121.551 1.59 . . . . 0.0 114.683 -179.753 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.9 tp -64.04 -54.68 38.19 Favored Pre-proline 0 C--N 1.361 1.104 0 O-C-N 121.326 -0.859 . . . . 0.0 112.82 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.97 -22.4 42.03 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.02 1.4 . . . . 0.0 114.506 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -70.86 -38.36 73.15 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.9 -33.49 68.37 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.465 HD21 ' CD1' ' A' ' 17' ' ' TYR . 80.1 mt -63.46 -39.47 94.55 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 121.644 -0.66 . . . . 0.0 109.529 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.7 m -64.07 -40.31 95.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.469 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.81 HD13 HD11 ' A' ' 42' ' ' ILE . 59.2 mt -69.04 -39.73 79.02 Favored 'General case' 0 C--N 1.361 1.077 0 CA-C-O 121.094 0.474 . . . . 0.0 110.016 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -51.78 -23.7 4.99 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 125.651 1.58 . . . . 0.0 113.408 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -66.91 -19.82 65.8 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.509 -0.744 . . . . 0.0 111.497 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 130.03 -0.69 5.74 Favored Glycine 0 C--N 1.359 1.844 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.3 m -66.64 -41.83 87.67 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 118.28 1.04 . . . . 0.0 109.515 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 m 65.72 177.91 0.21 Allowed 'General case' 0 C--N 1.375 1.678 0 CA-C-O 121.676 0.751 . . . . 0.0 110.848 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.81 HD11 HD13 ' A' ' 36' ' ' LEU . 3.0 mp -132.59 126.8 55.45 Favored 'Isoleucine or valine' 0 C--N 1.359 0.98 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -154.99 133.65 12.03 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.05 -170.22 43.33 Favored Glycine 0 CA--C 1.491 -1.425 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 50.3 m -120.69 114.45 21.69 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -91.53 129.07 37.57 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.21 123.15 27.68 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.915 1.341 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.563 HG13 ' HB3' ' A' ' 104' ' ' TYR . 92.7 t -107.2 116.47 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.24 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 177.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -72.33 136.69 46.27 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.589 0.709 . . . . 0.0 109.39 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.28 -8.1 62.4 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 110.277 -1.129 . . . . 0.0 110.277 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.8 -104.15 0.61 Allowed Glycine 0 C--N 1.354 1.561 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.14 159.16 21.37 Favored Pre-proline 0 N--CA 1.448 -0.562 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.7 124.01 7.88 Favored 'Trans proline' 0 CA--C 1.515 -0.466 0 C-N-CA 121.341 1.361 . . . . 0.0 112.818 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.52 136.15 45.07 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 CA-C-O 122.244 1.021 . . . . 0.0 108.927 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 57.8 m -65.02 141.47 58.75 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.165 0.983 . . . . 0.0 112.276 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -141.06 144.42 34.94 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 54.8 t -130.38 131.79 65.17 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.54 134.3 33.72 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.7 m -131.16 132.21 44.59 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 122.19 0.995 . . . . 0.0 109.099 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -113.97 132.15 56.07 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.8 t -164.17 179.19 7.05 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.91 99.93 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.297 0 CA-C-O 122.628 1.204 . . . . 0.0 109.383 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.8 t -100.59 144.53 28.67 Favored Pre-proline 0 C--N 1.354 0.779 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -49.37 149.71 8.98 Favored 'Trans proline' 0 CA--C 1.501 -1.136 0 C-N-CA 122.526 2.15 . . . . 0.0 116.334 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.0 tp -46.72 -51.06 40.12 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.27 -6.35 17.11 Favored 'Trans proline' 0 C--N 1.353 0.778 0 CA-C-N 121.44 1.55 . . . . 0.0 112.425 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.25 27.23 9.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.898 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -68.54 64.8 0.11 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-O 121.252 0.549 . . . . 0.0 110.582 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.2 mtt -125.02 152.87 43.68 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.784 0.802 . . . . 0.0 108.966 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.7 m -95.92 132.86 40.76 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -109.99 131.91 54.63 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 122.194 2.27 . . . . 0.0 109.824 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.5 t -125.08 137.45 54.2 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -115.18 125.33 53.28 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.3 129.33 47.49 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.09 138.87 39.35 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -86.02 112.3 21.1 Favored 'General case' 0 C--N 1.349 0.575 0 O-C-N 121.266 -0.896 . . . . 0.0 109.205 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.1 t30 63.83 26.69 14.41 Favored 'General case' 0 C--N 1.372 1.569 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.131 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 64.93 24.19 12.66 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 123.529 0.732 . . . . 0.0 110.895 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.63 116.15 28.75 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.59 -25.38 68.05 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -75.79 -14.15 60.3 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 121.195 -0.941 . . . . 0.0 109.613 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.9 mt -116.94 85.6 2.35 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.3 m -120.36 130.19 54.29 Favored 'General case' 0 C--N 1.361 1.106 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -109.17 132.3 54.24 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -118.5 107.88 14.32 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.8 mm -118.87 118.96 59.53 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.191 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.97 141.97 46.36 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -150.08 160.14 34.05 Favored Pre-proline 0 CA--C 1.51 -0.564 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.31 150.38 15.01 Favored 'Trans proline' 0 N--CA 1.485 0.979 0 C-N-CA 122.16 1.907 . . . . 0.0 111.716 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -62.7 -19.18 63.63 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 120.323 -1.486 . . . . 0.0 113.728 -174.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -89.1 -24.58 22.23 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.45 -29.34 16.31 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 123.124 0.57 . . . . 0.0 111.137 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.68 -39.82 94.32 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 122.035 -0.416 . . . . 0.0 111.905 -176.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -63.97 -37.53 87.74 Favored 'General case' 0 C--N 1.359 0.995 0 O-C-N 120.447 -1.408 . . . . 0.0 110.269 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -58.16 -41.36 83.63 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 120.271 1.396 . . . . 0.0 109.593 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -61.19 -48.3 82.18 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 109.952 175.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.92 -41.54 91.97 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.762 -176.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.72 -45.45 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 121.429 -0.794 . . . . 0.0 109.59 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.82 -40.8 98.49 Favored 'General case' 0 C--N 1.36 1.049 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.125 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -62.65 -47.65 82.79 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 122.635 0.374 . . . . 0.0 110.728 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.12 -44.94 82.85 Favored 'General case' 0 C--N 1.36 1.058 0 CA-C-O 121.446 0.641 . . . . 0.0 109.864 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.5 ttt -61.81 -48.73 79.3 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.482 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.14 -46.66 92.75 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 121.282 -0.886 . . . . 0.0 113.617 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.563 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.2 m-85 -88.15 -39.22 14.71 Favored 'General case' 0 C--N 1.36 1.053 0 CA-C-N 119.328 1.564 . . . . 0.0 113.793 -176.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -83.86 -53.38 5.64 Favored 'General case' 0 C--N 1.354 0.787 0 O-C-N 120.29 -1.507 . . . . 0.0 111.983 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -62.84 -40.78 98.49 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.3 mmt -85.41 -20.69 29.45 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 121.017 -1.052 . . . . 0.0 110.833 -176.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 60.03 53.78 4.46 Favored 'General case' 0 C--N 1.366 1.316 0 CA-C-O 122.387 1.089 . . . . 0.0 111.835 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.73 155.36 38.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.5 m -109.85 55.53 0.64 Allowed 'General case' 0 C--N 1.364 1.237 0 CA-C-O 122.127 0.965 . . . . 0.0 108.677 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -132.49 115.34 15.38 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.449 -1.685 . . . . 0.0 106.449 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -85.4 144.72 40.98 Favored Pre-proline 0 C--N 1.35 0.622 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -63.77 143.79 87.24 Favored 'Trans proline' 0 CA--C 1.518 -0.28 0 C-N-CA 121.48 1.453 . . . . 0.0 112.793 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.89 96.54 Favored Glycine 0 C--N 1.355 1.627 0 O-C-N 121.743 -0.598 . . . . 0.0 112.906 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -73.17 -28.32 62.15 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.903 1.351 . . . . 0.0 109.681 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -73.34 -36.53 66.18 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -70.6 -23.14 62.51 Favored 'General case' 0 C--N 1.365 1.279 0 O-C-N 121.909 -0.494 . . . . 0.0 110.369 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -61.83 -47.0 87.03 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-O 122.189 0.995 . . . . 0.0 109.345 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -66.31 -39.32 89.21 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.649 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.07 -43.4 78.66 Favored 'General case' 0 C--N 1.364 1.203 0 O-C-N 121.826 -0.546 . . . . 0.0 110.332 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.58 -40.87 89.16 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.362 1.976 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -179.998 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.433 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 57.1 ttp180 . . . . . 0 CA--C 1.519 -0.226 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.2 pt -61.73 -20.66 23.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.272 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.433 ' H ' ' HG2' ' A' ' 2' ' ' ARG . 98.4 m-20 -74.08 -9.91 59.09 Favored 'General case' 0 C--N 1.362 1.13 0 O-C-N 121.373 -0.829 . . . . 0.0 110.248 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -90.29 -6.9 54.61 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 80.7 mt -106.84 -108.67 0.31 Allowed 'General case' 0 C--N 1.352 0.701 0 CA-C-O 122.099 0.952 . . . . 0.0 109.253 -178.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.4 p -89.62 152.49 47.13 Favored Pre-proline 0 C--O 1.236 0.389 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -57.68 125.99 20.44 Favored 'Trans proline' 0 C--N 1.348 0.539 0 CA-C-N 119.737 0.942 . . . . 0.0 111.259 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.89 120.09 23.0 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 123.251 1.501 . . . . 0.0 112.761 -175.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -83.49 162.32 53.84 Favored Pre-proline 0 N--CA 1.443 -0.787 0 CA-C-N 113.388 -1.733 . . . . 0.0 106.403 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -55.79 -24.59 47.49 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.488 2.125 . . . . 0.0 113.692 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.6 mtt180 -75.13 -52.25 11.43 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 124.513 1.125 . . . . 0.0 108.289 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.8 77.95 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.23 1.412 . . . . 0.0 110.802 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -60.96 -44.05 97.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.565 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.17 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.3 m -72.69 -37.46 67.84 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.79 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.71 -40.64 76.17 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 121.583 -0.698 . . . . 0.0 110.297 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -71.23 -20.44 62.25 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.1 m -58.95 -54.84 52.47 Favored Pre-proline 0 N--CA 1.486 1.349 0 O-C-N 120.976 -1.078 . . . . 0.0 113.422 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo . . . . . 0 C--N 1.348 0.514 0 CA-C-N 121.323 1.508 . . . . 0.0 113.958 178.367 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 . . . . . 0 CA--C 1.534 0.338 0 CA-C-O 119.822 -0.132 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.468 ' HB3' ' HD3' ' A' ' 31' ' ' PRO . 46.0 tp -64.96 -56.06 23.34 Favored Pre-proline 0 C--N 1.367 1.331 0 O-C-N 121.367 -0.833 . . . . 0.0 112.431 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 30' ' ' LEU . 37.7 Cg_exo -61.52 -23.08 76.05 Favored 'Trans proline' 0 C--N 1.358 1.047 0 CA-C-N 121.185 1.459 . . . . 0.0 115.09 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -68.16 -36.26 79.37 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.96 -19.13 60.24 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 121.955 -0.466 . . . . 0.0 109.952 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.8 mt -70.77 -20.12 62.64 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 121.378 -0.827 . . . . 0.0 109.821 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.6 m -84.68 -18.25 35.92 Favored 'General case' 0 C--N 1.351 0.657 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.717 HD13 HD11 ' A' ' 42' ' ' ILE . 70.0 mt -88.38 -43.79 11.24 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -55.61 -25.68 39.95 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 124.466 1.106 . . . . 0.0 113.07 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.21 -10.5 54.9 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 121.444 -0.785 . . . . 0.0 111.892 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.58 5.64 11.03 Favored Glycine 0 C--N 1.375 2.703 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 m -71.17 -43.03 68.29 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 118.259 1.029 . . . . 0.0 109.293 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.6 t 67.33 179.77 0.22 Allowed 'General case' 0 C--N 1.374 1.656 0 CA-C-O 121.592 0.71 . . . . 0.0 110.712 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.717 HD11 HD13 ' A' ' 36' ' ' LEU . 3.0 mp -136.09 125.16 38.63 Favored 'Isoleucine or valine' 0 C--N 1.358 0.972 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -150.98 127.39 10.69 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 103.285 -2.857 . . . . 0.0 103.285 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -179.83 -172.36 43.77 Favored Glycine 0 CA--C 1.493 -1.313 0 N-CA-C 108.539 -1.824 . . . . 0.0 108.539 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 51.1 m -121.09 115.72 23.63 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -95.72 132.47 40.88 Favored 'General case' 0 C--N 1.355 0.812 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.25 22.52 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-O 122.663 1.22 . . . . 0.0 110.146 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.506 HG13 ' HB3' ' A' ' 104' ' ' TYR . 91.6 t -101.21 115.56 43.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 N-CA-C 104.334 -2.469 . . . . 0.0 104.334 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -70.61 136.56 49.26 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.52 -6.1 57.36 Favored Glycine 0 C--N 1.359 1.839 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.1 -103.38 0.4 Allowed Glycine 0 C--N 1.355 1.604 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.12 160.87 24.46 Favored Pre-proline 0 N--CA 1.448 -0.563 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -177.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.9 126.17 10.46 Favored 'Trans proline' 0 CA--C 1.513 -0.528 0 C-N-CA 121.353 1.369 . . . . 0.0 113.403 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 2.7 pt -109.47 137.42 41.69 Favored 'Isoleucine or valine' 0 C--N 1.357 0.913 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 59.7 m -65.84 143.93 57.16 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-O 122.078 0.942 . . . . 0.0 111.466 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -140.92 144.42 35.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.9 t -129.2 131.96 67.32 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 N-CA-C 106.486 -1.672 . . . . 0.0 106.486 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.64 130.15 29.63 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.5 m -128.12 131.09 49.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.505 1.145 . . . . 0.0 109.554 -177.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -110.95 124.36 51.98 Favored 'General case' 0 C--N 1.354 0.791 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.5 m -152.01 147.56 26.66 Favored 'General case' 0 CA--C 1.488 -1.413 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -71.19 100.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-O 122.694 1.235 . . . . 0.0 110.765 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.7 p -99.87 161.86 22.97 Favored Pre-proline 0 C--N 1.354 0.767 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 178.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -51.29 153.78 9.22 Favored 'Trans proline' 0 C--O 1.206 -1.122 0 C-N-CA 122.151 1.9 . . . . 0.0 115.721 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.6 tp -46.45 -54.31 19.2 Favored Pre-proline 0 CA--C 1.549 0.918 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -74.1 -6.9 19.18 Favored 'Trans proline' 0 C--N 1.353 0.77 0 CA-C-N 121.321 1.507 . . . . 0.0 112.946 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.35 24.97 10.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.333 -0.849 . . . . 0.0 108.962 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -73.63 68.91 1.24 Allowed 'General case' 0 C--N 1.379 1.877 0 CA-C-O 121.927 0.87 . . . . 0.0 109.471 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.7 mtt -120.5 154.11 35.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.916 0.865 . . . . 0.0 109.896 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 79.3 m -96.33 137.03 36.0 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 -112.69 130.16 56.15 Favored 'General case' 0 C--N 1.36 1.057 0 CA-C-N 122.261 2.301 . . . . 0.0 109.385 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.5 t -123.36 138.77 54.53 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -120.07 125.25 47.84 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.6 mt -128.43 140.24 51.94 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.5 pm0 -127.97 142.9 51.11 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 178.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -91.1 124.2 35.14 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.534 -0.729 . . . . 0.0 110.793 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 60.87 24.15 14.15 Favored 'General case' 0 C--N 1.374 1.649 0 C-N-CA 124.176 0.99 . . . . 0.0 110.995 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 63.38 26.89 15.15 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 123.344 0.658 . . . . 0.0 110.534 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -93.11 122.36 35.4 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.76 -16.16 63.72 Favored 'General case' 0 C--N 1.352 0.698 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -88.0 -2.88 58.88 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 120.863 -1.148 . . . . 0.0 109.466 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.2 mt -124.05 94.87 4.35 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 -178.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 74.2 p -128.67 151.05 49.96 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-O 121.755 0.788 . . . . 0.0 109.174 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -137.4 132.52 33.6 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.83 111.62 18.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 103.489 -2.782 . . . . 0.0 103.489 177.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.8 mm -119.3 117.82 55.38 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.985 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.2 139.63 44.67 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -152.92 162.64 25.87 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -52.55 149.27 24.56 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 C-N-CA 122.389 2.059 . . . . 0.0 112.298 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -59.52 -19.82 50.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.964 -1.085 . . . . 0.0 113.814 -174.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -88.77 -45.58 9.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -71.53 -35.45 70.69 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.197 0.599 . . . . 0.0 111.068 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -62.72 -38.99 92.67 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 123.033 0.533 . . . . 0.0 111.673 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.03 -26.38 67.49 Favored 'General case' 0 C--O 1.207 -1.18 0 O-C-N 120.286 -1.509 . . . . 0.0 110.619 -177.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.99 -40.77 97.14 Favored 'General case' 0 C--N 1.374 1.647 0 CA-C-N 119.993 1.27 . . . . 0.0 108.585 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -61.99 -47.11 86.29 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 123.935 0.894 . . . . 0.0 109.507 175.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.1 tp -60.89 -42.69 98.48 Favored 'General case' 0 C--N 1.357 0.929 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.739 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -45.95 97.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.416 -0.803 . . . . 0.0 109.653 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.71 -41.25 99.05 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.481 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 66.4 ttp -63.07 -48.7 77.5 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 122.686 0.394 . . . . 0.0 111.092 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -66.35 -45.95 78.44 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-O 121.604 0.716 . . . . 0.0 109.9 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.85 -50.33 71.35 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.157 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.12 -45.1 97.23 Favored Glycine 0 C--N 1.359 1.83 0 CA-C-O 119.123 -0.821 . . . . 0.0 115.112 -174.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.506 ' HB3' HG13 ' A' ' 48' ' ' VAL . 76.4 m-85 -84.57 -33.59 23.38 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-N 119.827 1.813 . . . . 0.0 111.867 -176.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -82.13 -49.52 10.07 Favored 'General case' 0 C--N 1.349 0.574 0 O-C-N 120.851 -1.156 . . . . 0.0 111.672 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -64.54 -43.82 92.75 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -85.22 -22.08 28.83 Favored 'General case' 0 C--N 1.367 1.33 0 O-C-N 120.684 -1.26 . . . . 0.0 110.704 -176.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 61.46 40.84 13.41 Favored 'General case' 0 C--N 1.367 1.364 0 CA-C-O 122.434 1.112 . . . . 0.0 110.461 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -125.46 147.57 49.16 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.386 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.4 p -91.06 -10.86 40.58 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -81.99 118.75 23.23 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -85.48 151.39 55.98 Favored Pre-proline 0 C--N 1.347 0.491 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -62.53 141.12 85.2 Favored 'Trans proline' 0 N--CA 1.473 0.322 0 C-N-CA 121.508 1.472 . . . . 0.0 113.078 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.6 -38.94 96.68 Favored Glycine 0 C--N 1.356 1.667 0 O-C-N 121.934 -0.478 . . . . 0.0 112.827 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.24 -29.45 63.95 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 118.811 1.305 . . . . 0.0 109.654 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.93 -35.32 67.0 Favored 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -70.75 -22.46 62.4 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 121.795 -0.566 . . . . 0.0 110.177 -178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -62.74 -45.77 91.16 Favored 'General case' 0 C--N 1.364 1.223 0 CA-C-O 122.136 0.969 . . . . 0.0 108.964 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.89 -40.21 96.85 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.809 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.62 -43.45 69.24 Favored 'General case' 0 C--N 1.358 0.978 0 O-C-N 122.065 -0.397 . . . . 0.0 110.385 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 55.6 tp -66.93 -40.67 87.66 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.834 0.454 . . . . 0.0 110.272 -179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.364 2.121 0 N-CA-C 110.039 -1.224 . . . . 0.0 110.039 179.304 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.7 ptt-85 . . . . . 0 C--O 1.236 0.356 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.9 pt -63.49 -21.59 28.83 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -79.44 -8.92 59.46 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 121.083 -1.011 . . . . 0.0 111.041 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -101.79 -1.62 31.93 Favored 'General case' 0 C--N 1.36 1.029 0 O-C-N 121.599 -0.688 . . . . 0.0 109.499 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.9 mt -102.77 -120.45 0.19 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-O 121.966 0.888 . . . . 0.0 108.785 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.719 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -89.23 158.43 46.49 Favored Pre-proline 0 C--N 1.347 0.459 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 179.551 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.719 ' HD2' HG22 ' A' ' 7' ' ' VAL . 88.6 Cg_exo -53.99 126.59 22.52 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 120.821 1.014 . . . . 0.0 112.617 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.07 118.8 18.42 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 123.2 1.476 . . . . 0.0 112.067 -176.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -84.24 160.74 56.59 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-N 113.372 -1.74 . . . . 0.0 106.909 176.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.08 -19.03 61.46 Favored 'Trans proline' 0 N--CA 1.486 1.072 0 C-N-CA 122.039 1.826 . . . . 0.0 113.416 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -76.5 -53.07 8.6 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.19 -46.59 79.33 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 125.436 1.495 . . . . 0.0 110.823 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -60.96 -42.67 93.77 Favored 'Isoleucine or valine' 0 C--N 1.349 0.576 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.9 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.3 m -71.52 -36.56 71.07 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.385 -176.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.2 mt -70.51 -40.67 73.37 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 121.656 -0.652 . . . . 0.0 110.323 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -72.42 -22.14 61.15 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -59.34 -54.58 54.78 Favored Pre-proline 0 N--CA 1.485 1.325 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo . . . . . 0 C--N 1.349 0.56 0 CA-C-N 121.308 1.503 . . . . 0.0 114.266 179.331 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 CA--C 1.532 0.277 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.0 tp -67.14 -56.02 14.33 Favored Pre-proline 0 C--N 1.365 1.245 0 O-C-N 121.238 -0.914 . . . . 0.0 112.9 -177.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.99 -18.31 31.33 Favored 'Trans proline' 0 C--N 1.356 0.974 0 CA-C-N 121.112 1.433 . . . . 0.0 114.046 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -69.41 -36.1 76.41 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.56 -18.48 59.74 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.932 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.91 -36.18 82.67 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 121.412 -0.805 . . . . 0.0 108.905 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -64.27 -38.25 90.36 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.001 -0.437 . . . . 0.0 110.044 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.573 ' CD2' HD11 ' A' ' 42' ' ' ILE . 7.5 mp -68.31 -43.98 76.42 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -55.01 -28.42 51.93 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 124.763 1.225 . . . . 0.0 112.602 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -65.09 -19.94 66.23 Favored 'General case' 0 C--N 1.361 1.099 0 O-C-N 121.257 -0.902 . . . . 0.0 111.064 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.23 11.21 7.58 Favored Glycine 0 C--N 1.36 1.915 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.3 m -65.73 -43.84 87.81 Favored 'General case' 0 C--N 1.361 1.088 0 CA-C-N 117.552 0.676 . . . . 0.0 109.437 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.9 m 65.28 173.94 0.21 Allowed 'General case' 0 C--N 1.375 1.675 0 CA-C-O 121.969 0.89 . . . . 0.0 111.356 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.573 HD11 ' CD2' ' A' ' 36' ' ' LEU . 2.7 mp -136.24 127.06 42.37 Favored 'Isoleucine or valine' 0 C--N 1.36 1.024 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -151.47 126.03 9.52 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 103.187 -2.894 . . . . 0.0 103.187 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.75 -169.19 41.08 Favored Glycine 0 CA--C 1.492 -1.367 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 p -121.54 115.9 23.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -92.56 130.45 38.2 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.85 118.49 22.41 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 122.874 1.321 . . . . 0.0 110.746 -176.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.443 HG13 ' HB3' ' A' ' 104' ' ' TYR . 93.4 t -99.01 109.55 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 176.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -70.31 132.5 45.78 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.59 -8.69 58.48 Favored Glycine 0 C--N 1.358 1.787 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.14 -107.12 0.9 Allowed Glycine 0 C--N 1.355 1.628 0 N-CA-C 108.668 -1.773 . . . . 0.0 108.668 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.5 157.98 24.69 Favored Pre-proline 0 N--CA 1.445 -0.697 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.78 124.95 9.12 Favored 'Trans proline' 0 CA--C 1.514 -0.508 0 C-N-CA 121.156 1.237 . . . . 0.0 112.891 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 pt -109.34 136.8 44.13 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 CA-C-O 122.055 0.931 . . . . 0.0 108.866 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.8 m -65.62 141.34 58.44 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-O 122.127 0.965 . . . . 0.0 111.918 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -140.74 144.09 35.33 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -130.49 131.89 64.9 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.412 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -138.35 131.96 30.8 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 176.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 66.8 p -129.56 157.88 40.84 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.31 1.053 . . . . 0.0 109.431 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -121.74 133.79 54.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 95.6 m -155.89 140.75 17.17 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.68 100.86 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-O 122.503 1.145 . . . . 0.0 109.924 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -99.54 164.44 16.61 Favored Pre-proline 0 C--N 1.354 0.786 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -52.41 155.76 9.27 Favored 'Trans proline' 0 C--O 1.206 -1.123 0 C-N-CA 122.249 1.966 . . . . 0.0 115.649 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.26 -53.66 37.25 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.04 -6.64 18.83 Favored 'Trans proline' 0 C--N 1.351 0.707 0 CA-C-N 121.247 1.481 . . . . 0.0 112.704 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.18 24.54 11.09 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.845 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.92 71.0 2.71 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -120.74 153.27 37.22 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.965 0.888 . . . . 0.0 109.976 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -95.38 135.17 37.33 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 178.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -111.11 131.32 55.18 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 121.94 2.154 . . . . 0.0 109.536 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.4 t -125.2 136.94 54.07 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.28 125.24 53.05 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.2 mt -126.55 129.18 48.09 Favored 'General case' 0 C--N 1.353 0.758 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.04 137.86 40.67 Favored 'General case' 0 C--N 1.356 0.874 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -85.79 110.04 19.08 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 121.369 -0.832 . . . . 0.0 109.667 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.0 t30 65.55 26.61 11.67 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 123.707 0.803 . . . . 0.0 109.948 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 65.08 24.1 12.48 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 123.519 0.728 . . . . 0.0 110.873 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.28 115.84 28.43 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.36 -26.08 68.25 Favored 'General case' 0 C--N 1.356 0.88 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -75.34 -14.62 60.49 Favored 'General case' 0 C--N 1.362 1.135 0 O-C-N 121.307 -0.871 . . . . 0.0 109.713 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.8 mt -116.53 84.26 2.1 Favored 'General case' 0 C--N 1.351 0.637 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.6 m -119.63 129.68 54.71 Favored 'General case' 0 C--N 1.361 1.081 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -109.39 133.17 53.4 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.58 109.29 15.99 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 103.467 -2.79 . . . . 0.0 103.467 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -119.02 117.7 55.15 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -176.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.34 140.63 45.22 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.3 mp -154.2 161.57 28.97 Favored Pre-proline 0 C--O 1.242 0.666 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 -179.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -53.27 145.91 42.37 Favored 'Trans proline' 0 CA--C 1.508 -0.813 0 C-N-CA 122.059 1.839 . . . . 0.0 111.788 176.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -60.51 -20.21 59.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.084 -1.01 . . . . 0.0 113.51 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -87.95 -22.82 24.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.682 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -95.69 -33.71 12.22 Favored 'General case' 0 C--N 1.361 1.084 0 O-C-N 121.821 -0.549 . . . . 0.0 111.069 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.85 -41.22 97.57 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -175.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.7 -32.7 73.83 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 120.678 -1.264 . . . . 0.0 111.228 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.36 -41.16 79.58 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.688 1.131 . . . . 0.0 109.753 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -66.87 -41.35 87.44 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 121.698 -0.626 . . . . 0.0 109.951 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -43.05 98.97 Favored 'General case' 0 C--N 1.357 0.921 0 CA-C-O 120.525 0.202 . . . . 0.0 111.018 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -43.84 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.642 -0.661 . . . . 0.0 109.378 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.99 -40.65 96.36 Favored 'General case' 0 C--N 1.363 1.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.056 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.9 ttp -62.66 -47.92 81.57 Favored 'General case' 0 C--N 1.356 0.855 0 CA-C-O 120.995 0.426 . . . . 0.0 110.794 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.87 -44.73 80.18 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 121.516 0.674 . . . . 0.0 109.709 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -62.17 -48.64 79.16 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.293 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.73 -46.6 93.34 Favored Glycine 0 C--N 1.354 1.562 0 O-C-N 121.243 -0.911 . . . . 0.0 113.753 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.443 ' HB3' HG13 ' A' ' 48' ' ' VAL . 56.4 m-85 -87.46 -39.28 15.35 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 119.54 1.67 . . . . 0.0 113.436 -176.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -82.51 -52.17 7.11 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.249 -1.532 . . . . 0.0 112.036 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -63.68 -41.75 98.13 Favored 'General case' 0 C--N 1.357 0.927 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 22.4 mmt -87.53 -22.72 24.69 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 121.017 -1.052 . . . . 0.0 110.714 -176.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 61.12 36.63 18.14 Favored 'General case' 0 C--N 1.366 1.31 0 CA-C-O 122.327 1.061 . . . . 0.0 110.854 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -116.16 140.37 49.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.327 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 t -89.19 -7.42 55.65 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -86.34 108.86 18.63 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -78.86 151.96 76.94 Favored Pre-proline 0 C--N 1.351 0.661 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.66 139.58 76.15 Favored 'Trans proline' 0 CA--C 1.517 -0.337 0 C-N-CA 121.668 1.579 . . . . 0.0 113.434 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.42 96.05 Favored Glycine 0 C--N 1.357 1.727 0 O-C-N 121.903 -0.498 . . . . 0.0 112.388 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.4 -34.07 75.38 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.612 1.206 . . . . 0.0 109.943 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -70.14 -40.03 75.05 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -71.21 -30.41 66.35 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 121.946 -0.471 . . . . 0.0 110.332 -178.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -60.72 -49.73 76.33 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.756 0.788 . . . . 0.0 110.05 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -67.16 -41.47 85.94 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.347 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.14 -41.27 74.1 Favored 'General case' 0 C--N 1.357 0.921 0 O-C-N 121.889 -0.507 . . . . 0.0 111.108 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.0 tp -69.71 -40.22 76.39 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 121.713 -0.617 . . . . 0.0 109.91 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.223 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.796 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 . . . . . 0 CA--C 1.518 -0.255 0 CA-C-O 121.736 0.779 . . . . 0.0 109.138 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.8 mm -61.47 -36.7 74.86 Favored 'Isoleucine or valine' 0 C--N 1.364 1.204 0 C-N-CA 124.088 0.955 . . . . 0.0 110.705 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -63.52 -15.06 56.87 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -176.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -91.69 -4.43 55.15 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 121.44 -0.787 . . . . 0.0 109.323 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.3 mt -106.37 -107.44 0.31 Allowed 'General case' 0 C--N 1.35 0.59 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.708 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -90.69 158.01 43.14 Favored Pre-proline 0 C--N 1.345 0.401 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 179.259 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.708 ' HD2' HG22 ' A' ' 7' ' ' VAL . 75.3 Cg_exo -56.5 128.11 28.7 Favored 'Trans proline' 0 N--CA 1.477 0.537 0 CA-C-N 119.703 0.93 . . . . 0.0 112.416 176.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.14 119.82 24.07 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 123.138 1.447 . . . . 0.0 111.905 -176.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -83.5 162.72 52.54 Favored Pre-proline 0 N--CA 1.443 -0.805 0 CA-C-N 113.484 -1.689 . . . . 0.0 106.716 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -55.86 -26.52 58.07 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 122.361 2.04 . . . . 0.0 113.401 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -72.54 -50.52 25.1 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 108.578 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -46.01 85.37 Favored 'General case' 0 C--N 1.363 1.169 0 C-N-CA 125.612 1.565 . . . . 0.0 110.935 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -61.04 -43.24 95.76 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.685 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.9 m -71.91 -36.86 70.11 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.187 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.22 -39.1 82.45 Favored 'General case' 0 C--N 1.37 1.461 0 O-C-N 121.325 -0.859 . . . . 0.0 110.199 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.403 ' CD1' HD21 ' A' ' 34' ' ' LEU . 70.3 t80 -74.24 -16.27 60.96 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.817 -0.552 . . . . 0.0 112.184 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.7 m -61.8 -52.03 71.59 Favored Pre-proline 0 N--CA 1.486 1.372 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo . . . . . 0 N--CA 1.487 1.113 0 CA-C-N 121.553 1.59 . . . . 0.0 115.439 179.832 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 . . . . . 0 N--CA 1.466 0.337 0 N-CA-C 111.584 0.216 . . . . 0.0 111.584 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.9 tp -64.1 -57.06 19.7 Favored Pre-proline 0 C--N 1.365 1.24 0 O-C-N 121.463 -0.773 . . . . 0.0 112.399 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.92 -17.26 32.45 Favored 'Trans proline' 0 C--N 1.355 0.921 0 CA-C-N 120.638 1.263 . . . . 0.0 114.957 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -68.32 -37.19 80.33 Favored 'General case' 0 C--N 1.359 1.007 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.44 -18.5 60.63 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 121.957 -0.465 . . . . 0.0 110.039 -177.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.403 HD21 ' CD1' ' A' ' 17' ' ' TYR . 94.5 mt -72.38 -22.32 61.15 Favored 'General case' 0 C--N 1.36 1.051 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 66.0 m -84.77 -25.39 28.25 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.591 ' CD2' HD11 ' A' ' 42' ' ' ILE . 6.4 mp -74.92 -41.34 59.88 Favored 'General case' 0 C--N 1.358 0.958 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.97 -29.14 59.78 Favored 'General case' 0 C--N 1.358 0.94 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.638 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -64.01 -13.32 45.83 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 121.285 -0.884 . . . . 0.0 112.79 -177.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.64 2.36 14.82 Favored Glycine 0 C--N 1.376 2.777 0 CA-C-N 119.953 1.251 . . . . 0.0 110.854 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.6 m -70.4 -42.17 72.04 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-N 118.531 1.165 . . . . 0.0 109.975 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 t 64.83 -175.9 0.17 Allowed 'General case' 0 C--N 1.372 1.572 0 CA-C-O 121.477 0.656 . . . . 0.0 110.943 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.591 HD11 ' CD2' ' A' ' 36' ' ' LEU . 2.8 mp -138.27 125.97 29.03 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -152.35 126.91 9.41 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.451 -2.796 . . . . 0.0 103.451 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.83 -169.02 40.8 Favored Glycine 0 CA--C 1.494 -1.245 0 N-CA-C 108.667 -1.773 . . . . 0.0 108.667 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 68.8 m -122.1 117.17 25.65 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -95.04 130.78 41.58 Favored 'General case' 0 C--N 1.355 0.807 0 N-CA-C 107.424 -1.325 . . . . 0.0 107.424 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.93 118.71 23.17 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-O 122.725 1.25 . . . . 0.0 109.8 -177.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.566 HG13 ' HB3' ' A' ' 104' ' ' TYR . 81.4 t -101.86 115.33 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.236 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 177.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -71.13 138.46 49.67 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.628 0.728 . . . . 0.0 109.479 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.21 -8.55 62.8 Favored Glycine 0 C--N 1.36 1.874 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.97 -103.53 0.55 Allowed Glycine 0 C--N 1.356 1.642 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.83 159.48 22.32 Favored Pre-proline 0 N--CA 1.447 -0.58 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.18 123.72 7.99 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.382 1.388 . . . . 0.0 112.84 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.4 pt -109.1 137.1 42.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.841 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 77.3 p -67.78 148.02 51.8 Favored 'General case' 0 C--N 1.364 1.206 0 CA-C-O 122.695 1.236 . . . . 0.0 112.188 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -145.8 146.52 31.21 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -129.86 130.76 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.75 135.79 35.06 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -134.99 154.1 51.85 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.406 1.098 . . . . 0.0 109.781 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.26 124.94 35.72 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.8 m -152.63 151.48 30.66 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 103.311 -2.848 . . . . 0.0 103.311 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.57 101.31 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 122.525 1.155 . . . . 0.0 111.177 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.1 p -99.25 157.34 34.21 Favored Pre-proline 0 C--N 1.352 0.717 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 176.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -50.46 151.05 10.58 Favored 'Trans proline' 0 CA--C 1.498 -1.293 0 C-N-CA 122.092 1.862 . . . . 0.0 115.586 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 tp -45.74 -52.97 22.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.01 -6.66 18.87 Favored 'Trans proline' 0 C--N 1.352 0.746 0 CA-C-N 121.582 1.601 . . . . 0.0 113.127 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.6 25.91 10.08 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 43.8 p-10 -72.67 63.41 0.6 Allowed 'General case' 0 C--N 1.374 1.635 0 CA-C-O 121.822 0.82 . . . . 0.0 111.328 -177.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -116.39 153.39 32.13 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 122.107 0.956 . . . . 0.0 110.244 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.8 m -96.72 135.8 38.14 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 104.829 -2.286 . . . . 0.0 104.829 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -113.32 132.51 55.54 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.285 2.311 . . . . 0.0 109.914 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 12.3 t -125.73 138.3 53.86 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -115.88 125.05 52.11 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 177.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.5 mt -127.07 128.15 45.82 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -104.84 135.78 45.57 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -85.99 114.3 22.77 Favored 'General case' 0 C--N 1.345 0.409 0 O-C-N 121.398 -0.814 . . . . 0.0 109.622 -177.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 63.58 25.52 14.39 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 123.825 0.85 . . . . 0.0 110.552 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 63.71 27.82 14.82 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 123.452 0.701 . . . . 0.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -96.36 114.29 25.95 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.03 -25.52 67.71 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -74.0 -16.71 61.05 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.265 -0.897 . . . . 0.0 109.416 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.7 mt -114.55 80.84 1.46 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 106.851 -1.536 . . . . 0.0 106.851 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.7 m -118.87 128.56 54.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -177.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -110.0 133.43 53.2 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -117.45 109.66 17.03 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 103.224 -2.88 . . . . 0.0 103.224 178.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.0 mm -118.82 118.74 58.79 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.165 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.14 141.57 45.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mp -150.67 160.32 32.77 Favored Pre-proline 0 CA--C 1.51 -0.562 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 -178.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -52.78 149.73 24.57 Favored 'Trans proline' 0 N--CA 1.482 0.848 0 C-N-CA 122.116 1.877 . . . . 0.0 111.273 176.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -62.35 -18.49 61.62 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.701 -1.25 . . . . 0.0 113.778 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -88.94 -22.94 22.82 Favored 'General case' 0 C--N 1.35 0.619 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -95.31 -30.13 14.11 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 122.002 -0.436 . . . . 0.0 110.772 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -64.66 -40.17 94.96 Favored 'General case' 0 C--N 1.364 1.196 0 O-C-N 121.919 -0.488 . . . . 0.0 111.62 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.28 -37.81 88.83 Favored 'General case' 0 C--N 1.36 1.041 0 O-C-N 120.355 -1.466 . . . . 0.0 109.814 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -58.98 -41.18 86.95 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 120.051 1.296 . . . . 0.0 109.487 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -61.03 -48.98 79.25 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 123.828 0.851 . . . . 0.0 109.939 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -40.94 88.16 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.021 0.528 . . . . 0.0 112.133 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.8 -46.91 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.57 -0.706 . . . . 0.0 109.851 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.77 -42.55 99.74 Favored 'General case' 0 C--N 1.359 0.994 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.395 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 64.2 ttp -63.52 -48.32 78.02 Favored 'General case' 0 C--N 1.356 0.873 0 CA-C-O 121.006 0.431 . . . . 0.0 110.859 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.6 tp -64.75 -49.16 71.88 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.367 0.603 . . . . 0.0 110.532 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.3 ttp -61.78 -50.28 72.97 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 122.834 0.453 . . . . 0.0 112.035 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.36 -44.69 97.72 Favored Glycine 0 C--N 1.359 1.812 0 CA-C-O 119.048 -0.862 . . . . 0.0 114.748 -174.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.566 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.0 m-85 -84.6 -32.3 23.82 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.707 1.753 . . . . 0.0 112.085 -176.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -83.47 -50.63 8.1 Favored 'General case' 0 C--N 1.35 0.592 0 O-C-N 120.79 -1.194 . . . . 0.0 111.5 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.8 ttt180 -63.37 -42.49 98.87 Favored 'General case' 0 C--N 1.358 0.97 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 38.7 mmt -82.33 -21.33 36.08 Favored 'General case' 0 C--N 1.368 1.407 0 O-C-N 120.757 -1.215 . . . . 0.0 110.395 -177.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 60.93 39.06 17.15 Favored 'General case' 0 C--N 1.369 1.427 0 CA-C-O 122.472 1.13 . . . . 0.0 110.494 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -137.32 145.69 43.72 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.033 -1.44 . . . . 0.0 107.239 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.3 m -95.83 56.34 1.72 Allowed 'General case' 0 C--N 1.358 0.939 0 CA-C-O 122.308 1.051 . . . . 0.0 108.252 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -127.09 132.95 50.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -105.55 148.15 35.87 Favored Pre-proline 0 C--N 1.349 0.582 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -65.06 141.56 70.61 Favored 'Trans proline' 0 CA--C 1.518 -0.287 0 C-N-CA 121.255 1.303 . . . . 0.0 112.191 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -39.56 97.42 Favored Glycine 0 C--N 1.357 1.731 0 O-C-N 121.818 -0.551 . . . . 0.0 112.769 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.33 -31.59 68.95 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 118.637 1.218 . . . . 0.0 109.926 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -71.16 -33.26 69.86 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -73.53 -17.46 61.2 Favored 'General case' 0 C--N 1.363 1.19 0 O-C-N 121.596 -0.69 . . . . 0.0 111.005 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -65.96 -43.01 89.18 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -64.76 -39.07 93.01 Favored 'General case' 0 C--N 1.353 0.725 0 CA-C-N 113.168 -1.833 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.12 -43.84 66.82 Favored 'General case' 0 C--N 1.359 0.983 0 O-C-N 121.839 -0.538 . . . . 0.0 110.202 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.5 tp -68.25 -40.62 81.88 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.696 0.398 . . . . 0.0 110.551 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.898 0 N-CA-C 107.918 -2.073 . . . . 0.0 107.918 -178.886 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 . . . . . 0 CA--C 1.514 -0.422 0 CA-C-O 122.068 0.937 . . . . 0.0 109.609 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.0 pt -70.5 -14.15 17.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.478 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.49 -10.47 59.82 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 121.082 -1.011 . . . . 0.0 110.168 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -91.03 -4.66 56.19 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.8 mt -107.16 -114.25 0.27 Allowed 'General case' 0 C--N 1.354 0.783 0 CA-C-O 121.851 0.834 . . . . 0.0 108.773 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.721 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -89.98 157.94 45.15 Favored Pre-proline 0 C--N 1.346 0.445 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.721 ' HD2' HG22 ' A' ' 7' ' ' VAL . 71.2 Cg_exo -56.04 128.8 31.74 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 120.845 1.03 . . . . 0.0 112.283 176.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.86 118.5 20.95 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-O 123.309 1.528 . . . . 0.0 112.552 -175.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -84.78 161.56 52.91 Favored Pre-proline 0 N--CA 1.443 -0.81 0 CA-C-N 113.252 -1.795 . . . . 0.0 106.328 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.41 -18.18 51.86 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 122.036 1.824 . . . . 0.0 113.568 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -79.07 -52.86 7.63 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.04 1.336 . . . . 0.0 107.624 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.9 -45.93 74.76 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 125.564 1.546 . . . . 0.0 110.987 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.6 t -60.45 -41.17 86.56 Favored 'Isoleucine or valine' 0 C--N 1.351 0.66 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.242 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 60.6 m -78.85 -19.26 52.45 Favored 'General case' 0 C--N 1.365 1.252 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.794 -175.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.2 mt -83.92 -43.38 15.32 Favored 'General case' 0 C--N 1.368 1.371 0 CA-C-N 119.283 0.947 . . . . 0.0 108.615 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -65.32 -42.25 93.18 Favored 'General case' 0 C--N 1.352 0.687 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 56.5 m -53.26 -53.15 59.22 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo . . . . . 0 C--O 1.233 0.252 0 CA-C-N 121.551 1.59 . . . . 0.0 113.859 179.301 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.4 tp -62.39 -51.61 72.11 Favored Pre-proline 0 C--N 1.358 0.936 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.7 -23.01 63.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-N 121.048 1.41 . . . . 0.0 115.633 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -76.69 -28.7 55.99 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 121.359 -0.838 . . . . 0.0 108.838 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.78 -18.65 50.5 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.43 -16.95 61.3 Favored 'General case' 0 C--N 1.359 0.999 0 O-C-N 121.001 -1.062 . . . . 0.0 108.658 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.9 m -85.09 -17.19 38.12 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.55 ' CD2' HD11 ' A' ' 42' ' ' ILE . 7.7 mp -86.13 -47.67 9.3 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -67.3 -11.53 57.81 Favored 'General case' 0 C--N 1.363 1.17 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.051 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -73.11 -12.26 60.84 Favored 'General case' 0 C--N 1.362 1.109 0 O-C-N 120.749 -1.219 . . . . 0.0 109.034 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.6 10.23 9.54 Favored Glycine 0 C--N 1.377 2.85 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -71.24 -45.54 63.02 Favored 'General case' 0 C--N 1.355 0.848 0 CA-C-N 118.718 1.259 . . . . 0.0 110.935 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.5 t 66.56 177.17 0.23 Allowed 'General case' 0 C--N 1.374 1.636 0 CA-C-O 121.19 0.519 . . . . 0.0 109.795 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.55 HD11 ' CD2' ' A' ' 36' ' ' LEU . 1.6 mp -140.53 129.03 25.04 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 O-C-N 120.642 -1.287 . . . . 0.0 108.931 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -154.65 125.76 7.24 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.3 -168.74 40.65 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 108.545 -1.822 . . . . 0.0 108.545 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 p -121.15 114.92 22.13 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -93.95 131.2 39.64 Favored 'General case' 0 C--N 1.355 0.83 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.95 126.37 31.86 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.762 1.268 . . . . 0.0 109.522 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.501 HG13 ' HB3' ' A' ' 104' ' ' TYR . 93.4 t -110.46 116.85 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.0 mp0 -73.31 135.54 44.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 94.83 9.42 58.54 Favored Glycine 0 C--N 1.359 1.837 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.96 -107.89 0.26 Allowed Glycine 0 CA--C 1.492 -1.386 0 N-CA-C 109.045 -1.622 . . . . 0.0 109.045 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.4 159.19 20.59 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.93 122.55 7.31 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.32 1.347 . . . . 0.0 112.622 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.0 pt -109.97 137.27 42.99 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 CA-C-O 122.152 0.977 . . . . 0.0 108.776 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.9 m -65.19 140.76 58.79 Favored 'General case' 0 C--N 1.365 1.271 0 CA-C-O 122.143 0.973 . . . . 0.0 111.541 178.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.05 143.5 36.4 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.6 t -129.34 132.6 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.532 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -136.32 128.65 30.11 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 177.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 p -127.97 164.58 22.01 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.874 0.845 . . . . 0.0 108.779 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 65.1 p-90 -137.22 153.94 50.28 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.558 HG23 HG23 ' A' ' 63' ' ' THR . 15.3 t -164.41 148.04 9.32 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 176.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -76.62 99.5 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 122.593 1.187 . . . . 0.0 108.994 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.558 HG23 HG23 ' A' ' 61' ' ' THR . 1.1 p -99.84 160.49 27.15 Favored Pre-proline 0 C--N 1.356 0.853 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -51.79 153.46 11.41 Favored 'Trans proline' 0 CA--C 1.501 -1.128 0 C-N-CA 122.175 1.917 . . . . 0.0 115.401 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.0 tp -41.09 -54.78 5.43 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.45 -8.48 22.69 Favored 'Trans proline' 0 C--N 1.353 0.789 0 CA-C-N 121.494 1.569 . . . . 0.0 113.303 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.41 24.0 11.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.03 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.76 73.85 3.41 Favored 'General case' 0 C--N 1.375 1.704 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.4 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 58.7 mtt -123.98 153.86 40.65 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.043 0.925 . . . . 0.0 110.886 -176.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.7 m -92.84 137.84 32.01 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -115.13 129.68 56.73 Favored 'General case' 0 C--N 1.364 1.21 0 CA-C-N 122.006 2.184 . . . . 0.0 109.456 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 8.9 t -125.33 140.62 52.66 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-O 122.048 0.928 . . . . 0.0 108.714 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -118.85 124.24 46.67 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 mt -126.45 127.43 45.39 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -100.77 138.91 37.19 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 179.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -85.93 112.14 20.9 Favored 'General case' 0 C--N 1.347 0.47 0 O-C-N 121.395 -0.815 . . . . 0.0 109.113 -177.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.9 25.85 15.27 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 123.755 0.822 . . . . 0.0 110.58 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 66.44 22.48 10.71 Favored 'General case' 0 C--N 1.371 1.533 0 C-N-CA 123.555 0.742 . . . . 0.0 110.864 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -91.87 115.6 28.2 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.43 -24.98 67.72 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -75.55 -14.34 60.4 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 121.331 -0.856 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.0 mt -117.08 87.06 2.62 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -122.07 131.67 54.1 Favored 'General case' 0 C--N 1.359 1.022 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -108.54 130.56 55.28 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -118.54 107.88 14.3 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 103.082 -2.932 . . . . 0.0 103.082 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 51.3 mm -122.91 120.18 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.0 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 -175.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.81 140.12 45.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.4 mp -152.33 161.08 30.31 Favored Pre-proline 0 C--O 1.238 0.486 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.4 ' HA ' ' HA ' ' A' ' 69' ' ' MET . 82.7 Cg_exo -52.82 147.87 30.72 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.2 1.933 . . . . 0.0 112.571 177.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -19.27 58.11 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.926 -1.109 . . . . 0.0 112.893 -175.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.7 p-80 -89.43 -24.54 21.86 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 121.573 -0.704 . . . . 0.0 109.587 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.19 -34.42 12.92 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 121.14 0.495 . . . . 0.0 111.021 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.16 -39.32 92.26 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 123.254 0.622 . . . . 0.0 112.542 -176.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.36 -31.96 73.37 Favored 'General case' 0 C--O 1.203 -1.366 0 O-C-N 120.509 -1.37 . . . . 0.0 110.333 -177.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.34 -42.01 85.9 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 119.862 1.21 . . . . 0.0 109.425 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -61.96 -47.7 83.69 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 123.093 0.557 . . . . 0.0 109.543 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -43.55 98.38 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.712 -176.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -46.03 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 121.431 -0.793 . . . . 0.0 109.485 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.75 -42.64 97.79 Favored 'General case' 0 C--N 1.361 1.097 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.02 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.2 ttp -62.32 -50.14 72.83 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 123.166 0.586 . . . . 0.0 111.27 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -65.67 -48.02 73.5 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-O 121.397 0.618 . . . . 0.0 111.006 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mmt -63.79 -51.87 62.84 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.69 -44.87 95.75 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 -174.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.501 ' HB3' HG13 ' A' ' 48' ' ' VAL . 49.3 m-85 -75.78 -36.84 59.67 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 119.37 1.585 . . . . 0.0 110.738 -176.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -73.78 -45.15 53.45 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 121.793 -0.567 . . . . 0.0 110.845 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -65.35 -46.28 80.82 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.8 mtm -85.4 -22.34 28.42 Favored 'General case' 0 C--N 1.367 1.347 0 O-C-N 120.811 -1.181 . . . . 0.0 111.194 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 60.11 38.64 20.31 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-O 122.338 1.066 . . . . 0.0 110.752 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -137.18 139.52 41.17 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.2 m -94.45 56.31 2.1 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -137.41 108.36 6.71 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.65 154.8 39.81 Favored Pre-proline 0 C--N 1.354 0.764 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -59.96 146.61 95.5 Favored 'Trans proline' 0 N--CA 1.475 0.413 0 C-N-CA 122.027 1.818 . . . . 0.0 113.696 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -66.33 -16.6 65.13 Favored Glycine 0 C--N 1.361 1.966 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.949 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.2 -33.45 73.35 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-N 119.125 1.463 . . . . 0.0 109.3 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -72.6 -34.75 67.61 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -72.26 -23.72 61.25 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.947 -0.47 . . . . 0.0 110.306 -178.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -63.78 -50.45 68.97 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-O 122.122 0.963 . . . . 0.0 109.322 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -67.58 -40.31 84.83 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.193 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -40.15 82.29 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 122.473 0.309 . . . . 0.0 110.863 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 58.4 tp -68.86 -40.93 79.05 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 121.608 -0.683 . . . . 0.0 109.755 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.204 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 179.402 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 . . . . . 0 CA--C 1.511 -0.532 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.5 pt -70.82 -18.17 20.74 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.29 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -73.62 -12.57 60.79 Favored 'General case' 0 C--N 1.36 1.027 0 O-C-N 121.196 -0.94 . . . . 0.0 111.29 -177.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -95.98 -2.88 46.09 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 90.2 mt -104.27 -114.66 0.23 Allowed 'General case' 0 C--N 1.348 0.528 0 CA-C-O 121.947 0.879 . . . . 0.0 109.136 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.72 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -89.49 158.11 46.24 Favored Pre-proline 0 C--N 1.345 0.405 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.72 ' HD2' HG22 ' A' ' 7' ' ' VAL . 89.1 Cg_exo -54.84 127.81 27.78 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 120.797 0.998 . . . . 0.0 112.421 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.08 118.92 19.34 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-O 123.163 1.459 . . . . 0.0 112.5 -175.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -84.21 160.23 57.75 Favored Pre-proline 0 N--CA 1.442 -0.829 0 CA-C-N 113.384 -1.734 . . . . 0.0 106.421 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -61.46 -22.44 74.53 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 121.727 1.618 . . . . 0.0 112.666 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -73.14 -50.47 22.48 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.514 1.126 . . . . 0.0 108.647 177.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.09 -46.27 85.79 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 125.495 1.518 . . . . 0.0 110.872 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.8 t -60.64 -42.92 93.6 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.95 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -71.84 -36.5 70.18 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 119.065 -1.054 . . . . 0.0 110.466 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.6 mt -70.8 -40.28 72.63 Favored 'General case' 0 C--N 1.368 1.402 0 O-C-N 121.62 -0.675 . . . . 0.0 110.533 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -71.65 -24.68 61.9 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.0 m -58.5 -54.19 58.56 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo . . . . . 0 C--N 1.348 0.521 0 CA-C-N 121.435 1.548 . . . . 0.0 114.748 -179.678 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.91 -61.06 8.76 Favored Pre-proline 0 C--N 1.364 1.231 0 CA-C-N 119.112 0.869 . . . . 0.0 112.738 -177.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -73.26 -18.69 23.22 Favored 'Trans proline' 0 C--N 1.351 0.692 0 CA-C-N 120.473 1.205 . . . . 0.0 115.06 -179.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -72.85 -30.7 64.21 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 121.473 -0.767 . . . . 0.0 109.517 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.05 -18.07 56.26 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.8 mt -66.07 -36.58 83.58 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.515 -0.74 . . . . 0.0 109.028 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -63.08 -37.98 89.36 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.919 -0.488 . . . . 0.0 109.865 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.644 HD23 HD11 ' A' ' 42' ' ' ILE . 7.1 mp -68.41 -43.91 76.17 Favored 'General case' 0 C--N 1.361 1.091 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -56.27 -35.82 67.87 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.505 1.122 . . . . 0.0 112.09 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.87 -27.73 69.0 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.56 -0.713 . . . . 0.0 111.54 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 133.49 12.12 1.63 Allowed Glycine 0 C--N 1.354 1.572 0 C-N-CA 120.0 -1.095 . . . . 0.0 111.246 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.1 m -68.93 -43.45 75.1 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 118.817 1.309 . . . . 0.0 109.669 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 t 65.58 176.03 0.21 Allowed 'General case' 0 C--N 1.374 1.662 0 CA-C-O 121.7 0.762 . . . . 0.0 111.056 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.644 HD11 HD23 ' A' ' 36' ' ' LEU . 2.2 mp -139.05 125.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -151.43 125.59 9.3 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 103.016 -2.957 . . . . 0.0 103.016 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.04 -169.89 41.9 Favored Glycine 0 CA--C 1.491 -1.436 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 -178.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.0 m -121.25 115.28 22.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -92.19 130.6 37.87 Favored 'General case' 0 C--N 1.357 0.913 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.99 122.34 27.17 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 122.904 1.335 . . . . 0.0 110.277 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.627 HG13 ' HB3' ' A' ' 104' ' ' TYR . 96.6 t -106.15 115.87 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.275 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -71.33 139.28 49.82 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.631 0.729 . . . . 0.0 109.677 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.91 -8.96 63.63 Favored Glycine 0 C--N 1.361 1.961 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -140.1 -102.85 0.53 Allowed Glycine 0 C--N 1.354 1.581 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.65 158.97 22.83 Favored Pre-proline 0 N--CA 1.448 -0.545 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.64 126.25 9.44 Favored 'Trans proline' 0 CA--C 1.513 -0.535 0 C-N-CA 121.427 1.418 . . . . 0.0 112.789 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.6 pt -109.56 136.43 45.49 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 CA-C-O 122.042 0.925 . . . . 0.0 108.793 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 61.1 m -64.66 140.84 58.91 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 122.141 0.972 . . . . 0.0 112.041 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -140.58 143.88 35.54 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.1 t -129.88 131.08 66.59 Favored 'Isoleucine or valine' 0 C--N 1.353 0.743 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.96 129.29 27.72 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 176.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -128.73 132.29 47.96 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -178.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.61 127.79 50.98 Favored 'General case' 0 C--N 1.352 0.689 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.5 m -153.59 148.35 26.42 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 103.517 -2.771 . . . . 0.0 103.517 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.65 102.91 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.216 0 CA-C-O 122.446 1.117 . . . . 0.0 111.019 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.1 p -99.03 158.58 32.05 Favored Pre-proline 0 C--N 1.354 0.765 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -49.87 155.59 4.0 Favored 'Trans proline' 0 C--O 1.203 -1.274 0 C-N-CA 122.605 2.204 . . . . 0.0 115.831 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.58 -51.15 75.99 Favored Pre-proline 0 N--CA 1.474 0.737 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.76 -4.57 15.61 Favored 'Trans proline' 0 CA--C 1.512 -0.577 0 CA-C-N 121.162 1.451 . . . . 0.0 112.15 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.93 26.15 9.87 Favored 'General case' 0 C--N 1.348 0.516 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.383 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.6 p-10 -73.02 61.94 0.6 Allowed 'General case' 0 C--N 1.374 1.633 0 CA-C-O 121.86 0.838 . . . . 0.0 111.184 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.426 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 58.9 mtt -117.44 153.29 33.36 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 122.003 0.906 . . . . 0.0 110.02 -177.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.9 m -96.1 135.46 37.86 Favored 'General case' 0 C--N 1.354 0.801 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 -111.5 132.03 54.79 Favored 'General case' 0 C--N 1.36 1.06 0 CA-C-N 122.095 2.225 . . . . 0.0 109.896 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.2 t -125.62 138.72 53.93 Favored 'General case' 0 C--N 1.35 0.616 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -116.63 125.19 51.43 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.33 130.73 50.02 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -104.48 138.94 40.11 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -85.85 113.29 21.88 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 121.232 -0.917 . . . . 0.0 109.477 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.9 t30 63.24 26.64 15.25 Favored 'General case' 0 C--N 1.373 1.596 0 C-N-CA 123.584 0.754 . . . . 0.0 110.018 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 65.68 23.49 11.6 Favored 'General case' 0 C--N 1.372 1.584 0 C-N-CA 123.557 0.743 . . . . 0.0 110.978 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -92.82 115.41 28.08 Favored 'General case' 0 C--N 1.353 0.759 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.98 -24.41 67.89 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -74.29 -16.48 60.93 Favored 'General case' 0 C--N 1.362 1.112 0 O-C-N 121.342 -0.849 . . . . 0.0 109.29 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.0 mt -115.48 87.21 2.62 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.5 m -120.7 130.5 54.11 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -177.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -109.23 132.69 53.89 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -119.01 108.5 14.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 103.23 -2.878 . . . . 0.0 103.23 177.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.7 mm -120.36 119.51 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.92 141.86 46.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.48 160.66 31.45 Favored Pre-proline 0 C--O 1.238 0.467 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 69' ' ' MET . 80.1 Cg_exo -53.83 151.2 26.99 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 122.246 1.964 . . . . 0.0 111.889 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.88 -18.02 53.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.639 -1.288 . . . . 0.0 113.312 -175.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -89.62 -28.45 19.5 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.359 -0.838 . . . . 0.0 108.89 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -92.26 -28.66 16.85 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 121.7 -0.625 . . . . 0.0 111.015 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.32 -38.75 92.15 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 121.676 -0.64 . . . . 0.0 111.591 -177.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.405 ' O ' HG13 ' A' ' 98' ' ' ILE . 8.6 mp -66.45 -32.89 74.54 Favored 'General case' 0 C--O 1.202 -1.426 0 O-C-N 120.488 -1.382 . . . . 0.0 109.66 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.58 -42.52 88.2 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 119.864 1.211 . . . . 0.0 109.024 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -62.65 -48.75 77.98 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.936 0.894 . . . . 0.0 110.243 175.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -43.08 99.44 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -176.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -63.54 -41.03 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 121.343 -0.848 . . . . 0.0 109.756 179.935 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.96 -39.6 92.69 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.925 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -63.44 -49.06 75.19 Favored 'General case' 0 C--N 1.362 1.146 0 CA-C-O 121.112 0.482 . . . . 0.0 110.945 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.3 -46.16 81.5 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-O 121.329 0.585 . . . . 0.0 110.087 -177.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -64.03 -50.44 68.46 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.636 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.91 -44.98 93.82 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.145 -0.808 . . . . 0.0 115.056 -175.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.627 ' HB3' HG13 ' A' ' 48' ' ' VAL . 57.6 m-85 -85.06 -33.53 22.45 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 119.753 1.776 . . . . 0.0 112.226 -175.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -81.7 -49.81 10.02 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 120.878 -1.139 . . . . 0.0 111.59 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -63.56 -44.78 93.15 Favored 'General case' 0 C--N 1.362 1.119 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -86.89 -21.28 26.43 Favored 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.841 -1.162 . . . . 0.0 110.55 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 64.28 34.95 10.28 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-O 122.488 1.137 . . . . 0.0 110.452 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -117.74 139.64 50.77 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.216 -1.357 . . . . 0.0 107.403 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 14.0 m -87.35 -16.81 33.94 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.71 124.38 27.16 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -92.87 156.28 40.79 Favored Pre-proline 0 C--N 1.348 0.532 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.9 142.26 87.65 Favored 'Trans proline' 0 CA--C 1.519 -0.266 0 C-N-CA 121.632 1.554 . . . . 0.0 113.048 177.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -38.16 95.27 Favored Glycine 0 C--N 1.358 1.754 0 O-C-N 121.844 -0.535 . . . . 0.0 112.535 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.66 72.56 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.659 1.23 . . . . 0.0 109.848 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -70.42 -33.29 71.17 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.58 -19.24 62.17 Favored 'General case' 0 C--N 1.363 1.184 0 O-C-N 121.702 -0.624 . . . . 0.0 110.98 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -64.78 -43.23 93.91 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-O 122.667 1.222 . . . . 0.0 107.995 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -65.0 -40.01 94.32 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 113.378 -1.737 . . . . 0.0 111.217 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.61 -41.79 68.46 Favored 'General case' 0 C--N 1.358 0.944 0 O-C-N 121.848 -0.533 . . . . 0.0 110.462 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.4 tp -68.3 -40.51 81.73 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 122.707 0.403 . . . . 0.0 110.491 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.884 0 N-CA-C 108.022 -2.031 . . . . 0.0 108.022 -179.079 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 . . . . . 0 C--O 1.234 0.239 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.5 pt -67.67 -22.02 27.97 Favored 'Isoleucine or valine' 0 C--N 1.366 1.292 0 O-C-N 121.735 -0.603 . . . . 0.0 112.349 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -72.43 -13.38 61.43 Favored 'General case' 0 C--N 1.362 1.125 0 O-C-N 121.271 -0.893 . . . . 0.0 110.978 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -93.72 -5.62 48.03 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.9 mt -104.7 -105.37 0.3 Allowed 'General case' 0 C--N 1.352 0.694 0 CA-C-O 122.024 0.916 . . . . 0.0 109.06 -179.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.5 p -89.8 151.48 45.56 Favored Pre-proline 0 C--O 1.236 0.346 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.34 125.65 19.07 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-N 119.792 0.962 . . . . 0.0 111.433 175.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.37 119.42 24.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 123.143 1.449 . . . . 0.0 112.106 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -83.88 161.8 54.47 Favored Pre-proline 0 N--CA 1.442 -0.837 0 CA-C-N 113.507 -1.679 . . . . 0.0 106.559 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -56.69 -24.72 56.3 Favored 'Trans proline' 0 N--CA 1.488 1.158 0 C-N-CA 122.381 2.054 . . . . 0.0 113.664 177.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -75.29 -52.23 11.35 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.65 -47.55 73.38 Favored 'General case' 0 C--N 1.368 1.377 0 C-N-CA 125.226 1.41 . . . . 0.0 110.767 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.05 -43.78 96.9 Favored 'Isoleucine or valine' 0 C--O 1.245 0.825 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.355 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.1 m -73.19 -36.74 66.61 Favored 'General case' 0 C--N 1.366 1.296 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.756 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.5 mt -71.45 -40.95 70.01 Favored 'General case' 0 C--N 1.365 1.276 0 O-C-N 121.649 -0.657 . . . . 0.0 110.389 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.579 ' CE1' HD11 ' A' ' 30' ' ' LEU . 70.6 t80 -63.79 -39.02 93.25 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -179.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.8 m -57.48 -55.22 46.79 Favored Pre-proline 0 CA--C 1.559 1.326 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo . . . . . 0 C--N 1.348 0.5 0 CA-C-N 121.597 1.606 . . . . 0.0 115.635 -178.878 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 . . . . . 0 N--CA 1.47 0.529 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.579 HD11 ' CE1' ' A' ' 17' ' ' TYR . 56.3 tp -60.53 -57.01 29.64 Favored Pre-proline 0 C--N 1.358 0.974 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -176.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -70.03 -23.08 29.96 Favored 'Trans proline' 0 CA--C 1.509 -0.729 0 CA-C-N 121.233 1.476 . . . . 0.0 114.67 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -71.25 -36.38 71.76 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.21 -17.89 60.26 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.456 -177.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.4 -19.36 63.81 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.02 -1.05 . . . . 0.0 109.902 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.4 m -84.6 -17.64 38.08 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.683 HD23 HD11 ' A' ' 42' ' ' ILE . 7.5 mp -88.03 -46.12 9.61 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -57.07 -23.9 50.02 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 124.416 1.086 . . . . 0.0 112.993 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -68.47 -10.52 55.96 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 121.275 -0.891 . . . . 0.0 111.632 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.25 11.11 11.04 Favored Glycine 0 C--N 1.375 2.714 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.7 m -70.49 -43.55 69.5 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.162 0.981 . . . . 0.0 109.69 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.5 t 68.91 175.79 0.28 Allowed 'General case' 0 C--N 1.375 1.716 0 CA-C-O 121.506 0.669 . . . . 0.0 110.465 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.683 HD11 HD23 ' A' ' 36' ' ' LEU . 2.9 mp -137.39 126.25 34.56 Favored 'Isoleucine or valine' 0 C--N 1.361 1.079 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -150.51 126.62 10.56 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 103.242 -2.873 . . . . 0.0 103.242 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.71 -169.87 41.55 Favored Glycine 0 CA--C 1.491 -1.437 0 N-CA-C 108.387 -1.885 . . . . 0.0 108.387 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.0 p -122.16 115.4 22.35 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.3 tpt180 -92.36 129.59 38.26 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.53 128.13 33.24 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-O 123.017 1.389 . . . . 0.0 110.713 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.528 HG13 ' HB3' ' A' ' 104' ' ' TYR . 83.6 t -110.23 116.21 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 N-CA-C 104.122 -2.547 . . . . 0.0 104.122 177.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -73.47 134.31 43.88 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.65 58.29 Favored Glycine 0 C--N 1.363 2.03 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.94 -105.28 0.62 Allowed Glycine 0 C--N 1.353 1.523 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.9 158.27 24.07 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.98 126.06 9.09 Favored 'Trans proline' 0 CA--C 1.513 -0.552 0 C-N-CA 121.439 1.426 . . . . 0.0 112.708 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.2 135.86 45.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 CA-C-O 122.173 0.987 . . . . 0.0 108.703 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.2 m -64.85 141.21 58.85 Favored 'General case' 0 C--N 1.364 1.231 0 CA-C-O 122.189 0.995 . . . . 0.0 111.683 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -141.1 144.76 35.08 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.8 t -129.36 130.16 67.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.53 134.55 34.03 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.6 t -131.61 149.47 52.49 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-O 122.582 1.182 . . . . 0.0 109.449 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.5 116.62 19.97 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -178.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.8 p -140.74 161.56 37.49 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.66 100.67 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.355 0 CA-C-O 122.397 1.094 . . . . 0.0 109.327 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -99.69 161.44 24.42 Favored Pre-proline 0 C--N 1.355 0.826 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -53.31 155.17 12.9 Favored 'Trans proline' 0 C--O 1.208 -1.009 0 C-N-CA 122.129 1.886 . . . . 0.0 115.566 179.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 41.5 tp -49.29 -50.65 63.21 Favored Pre-proline 0 CA--C 1.546 0.798 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -177.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -73.33 -8.49 21.95 Favored 'Trans proline' 0 C--N 1.352 0.759 0 CA-C-N 121.204 1.466 . . . . 0.0 112.394 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.38 25.01 10.75 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.096 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -75.33 65.97 1.71 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-O 122.224 1.011 . . . . 0.0 109.066 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 72.3 mtm -120.99 153.38 37.4 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 121.86 0.838 . . . . 0.0 109.525 -177.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 60.4 m -94.44 137.24 33.82 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -115.85 129.77 56.56 Favored 'General case' 0 C--N 1.362 1.124 0 CA-C-N 122.105 2.23 . . . . 0.0 109.208 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 10.6 t -125.53 139.12 53.88 Favored 'General case' 0 C--N 1.352 0.677 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -119.71 125.59 49.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 mt -126.64 135.18 50.85 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -103.62 139.95 38.23 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.32 106.97 17.76 Favored 'General case' 0 C--N 1.344 0.358 0 O-C-N 121.259 -0.9 . . . . 0.0 109.426 -178.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.2 t30 65.52 27.35 11.66 Favored 'General case' 0 C--N 1.374 1.656 0 C-N-CA 123.654 0.782 . . . . 0.0 109.967 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 65.55 23.79 11.78 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 123.637 0.775 . . . . 0.0 110.887 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -91.73 117.66 29.96 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.24 -19.52 66.01 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -86.21 -4.88 59.26 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 121.353 -0.842 . . . . 0.0 109.727 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.4 mt -125.82 94.54 4.15 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 -178.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 81.9 p -126.07 149.63 48.75 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.067 0.936 . . . . 0.0 109.321 -176.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -127.18 132.93 50.39 Favored 'General case' 0 CA--C 1.489 -1.39 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -121.02 110.4 16.22 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 104.028 -2.582 . . . . 0.0 104.028 178.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.3 mm -120.63 116.85 51.31 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.39 139.69 44.39 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.98 162.67 26.69 Favored Pre-proline 0 C--O 1.238 0.464 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 -178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -53.25 147.81 34.47 Favored 'Trans proline' 0 N--CA 1.483 0.871 0 C-N-CA 122.372 2.048 . . . . 0.0 112.0 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -18.76 52.05 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -174.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -89.13 -27.61 20.61 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.441 -0.787 . . . . 0.0 108.955 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.69 -31.65 15.03 Favored 'General case' 0 C--N 1.356 0.885 0 O-C-N 121.769 -0.582 . . . . 0.0 111.201 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -63.71 -39.83 95.28 Favored 'General case' 0 C--N 1.36 1.027 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.59 -28.3 69.84 Favored 'General case' 0 C--N 1.365 1.249 0 O-C-N 120.492 -1.38 . . . . 0.0 110.954 -177.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.12 -40.99 87.13 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.388 0.994 . . . . 0.0 109.249 177.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -67.83 -42.98 80.64 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 123.029 0.532 . . . . 0.0 109.831 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -43.5 98.69 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -175.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -42.28 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 121.493 -0.754 . . . . 0.0 109.368 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -63.01 -39.7 95.55 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.276 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.26 -44.82 94.06 Favored 'General case' 0 C--N 1.364 1.202 0 O-C-N 121.76 -0.587 . . . . 0.0 110.831 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 81.4 mt -69.19 -44.52 71.99 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-O 121.412 0.625 . . . . 0.0 109.551 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.0 ttp -62.55 -48.91 77.4 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.387 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.84 -47.22 90.67 Favored Glycine 0 C--N 1.353 1.524 0 O-C-N 121.14 -0.975 . . . . 0.0 113.913 -176.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.528 ' HB3' HG13 ' A' ' 48' ' ' VAL . 62.0 m-85 -87.85 -38.93 15.25 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-N 119.557 1.679 . . . . 0.0 113.622 -175.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -83.59 -51.64 7.13 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 120.302 -1.499 . . . . 0.0 111.794 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -64.6 -41.67 96.07 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.7 mmt -84.52 -21.16 30.65 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.967 -1.083 . . . . 0.0 110.423 -176.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 60.37 43.47 13.39 Favored 'General case' 0 C--N 1.369 1.436 0 CA-C-O 122.395 1.093 . . . . 0.0 110.753 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -134.96 144.8 47.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.922 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.68 -9.69 48.56 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -80.62 120.6 24.77 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -92.34 151.24 41.3 Favored Pre-proline 0 C--N 1.349 0.554 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -63.82 141.95 80.53 Favored 'Trans proline' 0 CA--C 1.517 -0.344 0 C-N-CA 121.721 1.614 . . . . 0.0 113.398 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.26 -37.64 94.9 Favored Glycine 0 C--N 1.357 1.743 0 O-C-N 121.862 -0.524 . . . . 0.0 112.449 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.47 -29.75 66.39 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 118.535 1.168 . . . . 0.0 109.887 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -36.45 64.96 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -69.71 -26.1 64.18 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.022 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.39 -48.54 80.76 Favored 'General case' 0 C--N 1.356 0.858 0 CA-C-O 122.133 0.968 . . . . 0.0 109.39 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -67.36 -42.18 83.9 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.287 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.5 -40.98 80.68 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.91 -0.494 . . . . 0.0 111.065 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 60.4 tp -67.08 -40.42 87.01 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.933 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 -179.983 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 . . . . . 0 CA--C 1.517 -0.312 0 CA-C-O 121.755 0.788 . . . . 0.0 108.969 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.3 pt -64.37 -21.29 28.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 123.546 0.738 . . . . 0.0 112.719 -178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -76.08 -8.6 57.37 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 121.131 -0.981 . . . . 0.0 111.165 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.39 -4.0 49.22 Favored 'General case' 0 C--N 1.357 0.915 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.6 mt -105.96 -112.93 0.26 Allowed 'General case' 0 C--N 1.349 0.553 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.707 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -90.01 158.3 44.57 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.707 ' HD2' HG22 ' A' ' 7' ' ' VAL . 82.3 Cg_exo -54.92 128.87 32.36 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 120.813 1.009 . . . . 0.0 112.288 176.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.93 117.59 16.94 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 123.161 1.457 . . . . 0.0 112.245 -175.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -85.68 161.45 50.71 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 113.409 -1.723 . . . . 0.0 106.986 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.7 -24.57 63.77 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.49 2.127 . . . . 0.0 113.432 177.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -74.07 -52.76 11.65 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.581 1.153 . . . . 0.0 107.961 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.61 -46.23 81.02 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.287 1.435 . . . . 0.0 110.764 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.6 t -61.0 -42.71 94.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -71.26 -36.01 71.59 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.303 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.78 -40.82 75.82 Favored 'General case' 0 C--N 1.369 1.433 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -75.33 -19.4 59.64 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.914 -0.491 . . . . 0.0 112.127 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.4 m -60.55 -54.99 49.38 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -177.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo . . . . . 0 CA--C 1.512 -0.59 0 CA-C-N 121.576 1.599 . . . . 0.0 114.224 -179.543 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 CA--C 1.535 0.382 0 CA-C-O 119.883 -0.103 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.4 tp -66.39 -55.03 21.2 Favored Pre-proline 0 C--N 1.367 1.351 0 O-C-N 121.283 -0.885 . . . . 0.0 112.345 -178.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -64.95 -20.25 64.14 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 120.804 1.323 . . . . 0.0 114.713 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -73.19 -29.47 62.85 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.43 -17.93 57.67 Favored 'General case' 0 C--N 1.365 1.259 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.29 -36.09 80.82 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.3 t -63.69 -38.08 89.76 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.601 HD23 HD11 ' A' ' 42' ' ' ILE . 7.1 mp -68.67 -45.23 72.26 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -57.93 -37.71 74.6 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 124.65 1.18 . . . . 0.0 112.583 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.69 -10.23 25.59 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 121.305 -0.872 . . . . 0.0 112.529 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 125.39 2.49 7.56 Favored Glycine 0 C--N 1.374 2.663 0 CA-C-N 119.466 1.03 . . . . 0.0 111.889 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.0 t -68.24 -46.0 71.7 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-N 119.259 1.529 . . . . 0.0 109.828 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.31 -178.34 0.15 Allowed 'General case' 0 C--N 1.371 1.517 0 CA-C-O 121.301 0.572 . . . . 0.0 110.75 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.601 HD11 HD23 ' A' ' 36' ' ' LEU . 1.7 mp -140.6 125.92 19.6 Favored 'Isoleucine or valine' 0 C--N 1.363 1.191 0 CA-C-O 122.511 1.148 . . . . 0.0 108.453 179.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -154.03 125.71 7.63 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.41 -170.24 42.21 Favored Glycine 0 CA--C 1.492 -1.374 0 N-CA-C 108.456 -1.858 . . . . 0.0 108.456 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -119.13 112.66 19.8 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.3 tpt180 -95.66 132.49 40.79 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.04 129.8 37.4 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.959 1.362 . . . . 0.0 110.32 -178.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.1 t -114.0 119.34 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 104.177 -2.527 . . . . 0.0 104.177 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -72.61 135.95 45.62 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.419 0.628 . . . . 0.0 109.333 -178.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.41 -5.3 57.19 Favored Glycine 0 C--N 1.36 1.879 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.77 -103.5 0.38 Allowed Glycine 0 C--N 1.355 1.616 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.429 ' HB1' ' HD2' ' A' ' 53' ' ' PRO . . . -162.56 162.24 19.24 Favored Pre-proline 0 N--CA 1.447 -0.576 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -177.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.429 ' HD2' ' HB1' ' A' ' 52' ' ' ALA . 70.5 Cg_endo -72.62 127.18 12.15 Favored 'Trans proline' 0 CA--C 1.514 -0.481 0 C-N-CA 121.161 1.24 . . . . 0.0 113.527 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 pt -110.19 137.75 41.1 Favored 'Isoleucine or valine' 0 C--N 1.358 0.963 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.9 m -64.34 140.57 58.88 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.133 0.968 . . . . 0.0 112.002 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -140.71 143.59 35.11 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -129.75 131.43 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.475 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -138.05 130.25 28.89 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.8 p -127.74 154.84 44.89 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-O 122.383 1.087 . . . . 0.0 109.55 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.02 132.13 46.11 Favored 'General case' 0 C--N 1.355 0.833 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.9 m -155.13 148.57 25.11 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 103.396 -2.816 . . . . 0.0 103.396 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.8 m -71.26 100.01 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 122.754 1.264 . . . . 0.0 110.134 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.1 p -100.63 163.75 17.52 Favored Pre-proline 0 C--N 1.356 0.877 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -53.29 154.66 13.97 Favored 'Trans proline' 0 C--O 1.208 -1.015 0 C-N-CA 122.037 1.825 . . . . 0.0 115.286 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 54.8 tp -50.03 -50.62 67.93 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -177.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -73.04 -8.35 22.05 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.193 1.462 . . . . 0.0 112.339 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.22 24.38 11.2 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.249 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.23 70.41 2.86 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-O 122.241 1.02 . . . . 0.0 108.26 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.6 mtt -120.35 154.35 35.19 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 122.006 0.908 . . . . 0.0 110.068 -177.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 58.8 m -95.33 133.96 38.66 Favored 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.038 -2.208 . . . . 0.0 105.038 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -112.4 130.81 55.84 Favored 'General case' 0 C--N 1.359 1.016 0 CA-C-N 122.251 2.296 . . . . 0.0 109.318 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.3 t -126.08 135.82 52.18 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -115.4 124.3 50.85 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mt -126.01 125.32 42.47 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -101.78 137.59 39.89 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -86.11 113.81 22.47 Favored 'General case' 0 C--N 1.348 0.518 0 O-C-N 121.344 -0.847 . . . . 0.0 109.127 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 41.3 t30 63.89 26.29 14.22 Favored 'General case' 0 C--N 1.372 1.573 0 C-N-CA 123.475 0.71 . . . . 0.0 110.303 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 64.28 25.07 13.47 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 123.397 0.679 . . . . 0.0 111.003 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -94.8 122.52 37.51 Favored 'General case' 0 C--N 1.355 0.816 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.6 -35.65 78.46 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -70.47 -17.35 62.98 Favored 'General case' 0 C--N 1.358 0.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.523 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.9 mt -111.99 84.09 1.9 Allowed 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -122.65 131.73 53.94 Favored 'General case' 0 C--N 1.362 1.139 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -108.75 130.74 55.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -119.43 107.83 13.81 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -121.58 119.4 58.82 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.22 140.75 45.52 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -151.66 160.44 31.7 Favored Pre-proline 0 C--O 1.24 0.589 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.41 149.46 23.23 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 122.323 2.015 . . . . 0.0 111.709 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -61.84 -19.91 63.1 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 120.562 -1.336 . . . . 0.0 113.839 -174.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 49.9 p-80 -89.18 -24.52 22.14 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.34 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.01 -29.08 15.41 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.975 -0.453 . . . . 0.0 111.181 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -63.42 -38.09 89.79 Favored 'General case' 0 C--N 1.36 1.039 0 O-C-N 121.838 -0.538 . . . . 0.0 111.566 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.401 ' O ' HG13 ' A' ' 98' ' ' ILE . 9.2 mp -66.28 -32.58 74.07 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.652 -1.28 . . . . 0.0 109.622 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -59.21 -42.45 91.0 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 120.225 1.375 . . . . 0.0 108.974 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -63.04 -48.68 77.7 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.916 0.886 . . . . 0.0 109.994 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.26 -43.14 99.37 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 94' ' ' LEU . 0.5 OUTLIER -63.84 -44.54 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 O-C-N 121.244 -0.91 . . . . 0.0 109.753 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.75 -40.14 96.31 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.54 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttm -62.49 -50.74 70.22 Favored 'General case' 0 C--N 1.358 0.944 0 C-N-CA 122.366 0.266 . . . . 0.0 110.586 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.57 -44.17 96.98 Favored 'General case' 0 C--N 1.362 1.111 0 CA-C-O 121.546 0.689 . . . . 0.0 109.923 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 60.1 ttm -62.24 -49.02 77.41 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.479 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.41 -49.45 73.93 Favored Glycine 0 C--N 1.359 1.837 0 CA-C-O 118.952 -0.916 . . . . 0.0 115.285 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -85.89 -33.13 21.32 Favored 'General case' 0 C--N 1.363 1.19 0 CA-C-N 120.175 1.987 . . . . 0.0 113.107 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -80.85 -50.22 10.08 Favored 'General case' 0 C--N 1.354 0.786 0 O-C-N 120.449 -1.407 . . . . 0.0 111.392 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -63.82 -43.9 94.85 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -177.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.0 mtp -88.41 -17.17 31.04 Favored 'General case' 0 C--N 1.363 1.167 0 O-C-N 121.164 -0.96 . . . . 0.0 110.783 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 62.18 42.58 9.42 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-O 122.459 1.123 . . . . 0.0 110.74 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.17 144.34 45.79 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.3 -1.318 . . . . 0.0 107.895 179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 24.1 p -89.09 -14.21 36.81 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 121.112 0.482 . . . . 0.0 109.708 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -98.85 127.14 44.7 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -85.02 162.36 49.72 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -59.15 148.1 87.41 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 121.568 1.512 . . . . 0.0 113.05 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -37.45 92.13 Favored Glycine 0 C--N 1.359 1.833 0 O-C-N 121.735 -0.603 . . . . 0.0 112.869 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.45 -26.38 63.62 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 118.798 1.299 . . . . 0.0 109.955 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -75.51 -30.78 59.92 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -73.07 -17.21 61.44 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 121.42 -0.8 . . . . 0.0 110.541 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -67.61 -42.58 82.18 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-O 122.761 1.267 . . . . 0.0 107.634 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -64.03 -41.09 97.53 Favored 'General case' 0 C--N 1.357 0.903 0 CA-C-N 113.188 -1.824 . . . . 0.0 110.814 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.4 mp -71.25 -40.02 71.26 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 122.086 -0.383 . . . . 0.0 110.294 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.8 tp -67.9 -39.72 83.56 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 122.729 0.412 . . . . 0.0 109.951 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.955 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 179.577 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 . . . . . 0 C--O 1.233 0.202 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.9 pt -59.35 -19.71 16.79 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -79.39 -2.98 44.24 Favored 'General case' 0 C--N 1.365 1.264 0 CA-C-N 120.208 1.367 . . . . 0.0 110.571 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.27 -5.29 44.01 Favored 'General case' 0 C--N 1.357 0.916 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -107.1 -112.26 0.29 Allowed 'General case' 0 C--N 1.353 0.751 0 CA-C-O 121.98 0.895 . . . . 0.0 108.778 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.714 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.0 158.3 44.59 Favored Pre-proline 0 C--N 1.345 0.389 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.714 ' HD2' HG22 ' A' ' 7' ' ' VAL . 81.5 Cg_exo -55.12 128.21 29.58 Favored 'Trans proline' 0 N--CA 1.478 0.577 0 CA-C-N 119.842 0.979 . . . . 0.0 112.257 176.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.06 117.79 18.98 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 123.119 1.437 . . . . 0.0 112.326 -175.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -85.64 160.78 52.65 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 113.487 -1.688 . . . . 0.0 106.933 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.5 -25.28 65.84 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.441 2.094 . . . . 0.0 113.513 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -74.86 -50.95 15.23 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -46.06 80.09 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 125.201 1.401 . . . . 0.0 110.586 177.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.1 t -61.24 -43.52 96.63 Favored 'Isoleucine or valine' 0 C--N 1.348 0.539 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.866 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.7 m -73.01 -34.49 66.41 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.79 -176.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -71.98 -41.04 68.15 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 121.36 -0.838 . . . . 0.0 110.26 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -70.44 -34.71 72.78 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.2 m -49.65 -51.61 58.09 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -176.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo . . . . . 0 CA--C 1.516 -0.407 0 CA-C-N 121.788 1.674 . . . . 0.0 113.196 178.625 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 111.83 0.308 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.73 -56.66 27.29 Favored Pre-proline 0 C--N 1.364 1.207 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.71 -19.31 36.55 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 120.94 1.371 . . . . 0.0 114.667 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -70.59 -37.84 73.95 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.31 -27.48 60.73 Favored 'General case' 0 C--N 1.366 1.285 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.03 -38.18 85.46 Favored 'General case' 0 C--N 1.365 1.26 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.6 m -65.4 -39.81 92.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.125 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.927 HD13 HD11 ' A' ' 42' ' ' ILE . 72.4 mt -69.07 -39.46 79.08 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 121.486 -0.759 . . . . 0.0 110.136 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -53.76 -27.05 26.41 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 125.355 1.462 . . . . 0.0 112.823 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -64.34 -11.97 37.61 Favored 'General case' 0 C--N 1.363 1.192 0 O-C-N 121.133 -0.979 . . . . 0.0 112.505 -178.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.78 -0.33 10.98 Favored Glycine 0 C--N 1.371 2.499 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.6 m -69.7 -41.65 75.13 Favored 'General case' 0 C--N 1.358 0.936 0 CA-C-N 118.241 1.021 . . . . 0.0 109.647 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 66.18 -178.89 0.2 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.558 0.695 . . . . 0.0 110.852 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.927 HD11 HD13 ' A' ' 36' ' ' LEU . 2.6 mp -135.79 124.88 39.7 Favored 'Isoleucine or valine' 0 C--N 1.358 0.975 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -150.06 126.65 10.91 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 103.193 -2.892 . . . . 0.0 103.193 178.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 179.17 -171.02 42.93 Favored Glycine 0 CA--C 1.492 -1.371 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -121.3 115.32 22.76 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 tpt180 -91.91 130.31 37.7 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.82 116.38 20.78 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.829 1.299 . . . . 0.0 110.478 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.472 HG13 ' HB3' ' A' ' 104' ' ' TYR . 91.5 t -96.91 109.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 N-CA-C 104.426 -2.435 . . . . 0.0 104.426 176.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -70.49 131.08 43.49 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.78 58.35 Favored Glycine 0 C--N 1.359 1.814 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -134.77 -107.88 0.96 Allowed Glycine 0 C--N 1.356 1.654 0 N-CA-C 108.604 -1.799 . . . . 0.0 108.604 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.57 158.38 25.04 Favored Pre-proline 0 N--CA 1.445 -0.699 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -178.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.58 121.62 6.46 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.179 1.253 . . . . 0.0 112.963 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 3.6 pt -108.31 136.05 45.12 Favored 'Isoleucine or valine' 0 C--N 1.358 0.978 0 CA-C-O 122.217 1.008 . . . . 0.0 108.709 -178.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.0 m -65.28 141.45 58.6 Favored 'General case' 0 C--N 1.364 1.196 0 CA-C-O 122.186 0.993 . . . . 0.0 112.099 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -141.19 145.29 35.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -129.71 130.61 66.84 Favored 'Isoleucine or valine' 0 C--N 1.351 0.664 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.56 136.06 35.65 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.2 t -135.09 152.62 51.83 Favored 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.324 1.059 . . . . 0.0 109.562 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -123.72 114.76 20.37 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 66.4 p -140.3 161.15 38.36 Favored 'General case' 0 CA--C 1.497 -1.093 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -79.6 101.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 CA-C-O 122.377 1.084 . . . . 0.0 109.835 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -99.45 161.77 23.47 Favored Pre-proline 0 C--N 1.355 0.821 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_exo -53.64 156.47 11.57 Favored 'Trans proline' 0 C--O 1.207 -1.067 0 C-N-CA 122.145 1.896 . . . . 0.0 115.772 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.8 tp -49.24 -53.54 38.38 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -73.73 -6.42 18.62 Favored 'Trans proline' 0 C--N 1.353 0.799 0 CA-C-N 121.226 1.474 . . . . 0.0 112.636 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -116.97 25.15 10.71 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.71 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 68.96 2.4 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-O 122.195 0.997 . . . . 0.0 108.555 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 59.1 mtt -125.46 152.82 44.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.925 -177.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -90.82 134.05 34.74 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -110.55 131.09 55.35 Favored 'General case' 0 C--N 1.36 1.031 0 CA-C-N 122.063 2.211 . . . . 0.0 109.726 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.1 t -124.96 136.66 53.95 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.6 123.86 49.5 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.0 131.59 52.19 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -178.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -101.71 140.42 36.02 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.119 -1.438 . . . . 0.0 107.119 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -85.86 110.7 19.58 Favored 'General case' 0 C--N 1.348 0.52 0 O-C-N 121.356 -0.84 . . . . 0.0 109.077 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.41 26.43 15.76 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 123.702 0.801 . . . . 0.0 110.595 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 67.41 21.77 9.59 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 123.604 0.762 . . . . 0.0 110.959 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -91.28 114.94 27.61 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.49 -24.71 67.62 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -74.6 -15.85 60.82 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.372 -0.83 . . . . 0.0 109.337 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.2 mt -116.04 87.49 2.69 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.4 m -120.94 130.65 53.94 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -109.11 133.15 53.38 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.64 108.76 15.33 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 103.388 -2.819 . . . . 0.0 103.388 177.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 118.67 57.41 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 -176.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.99 141.79 46.31 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -151.04 159.06 34.34 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -52.26 149.62 21.91 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 C-N-CA 122.398 2.066 . . . . 0.0 111.973 176.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.22 -19.38 54.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.784 -1.198 . . . . 0.0 113.538 -174.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -89.8 -23.74 21.65 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.306 -0.871 . . . . 0.0 109.787 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -94.39 -30.45 14.48 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 123.054 0.541 . . . . 0.0 111.357 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.82 -39.27 93.78 Favored 'General case' 0 C--N 1.361 1.1 0 O-C-N 121.901 -0.499 . . . . 0.0 112.204 -176.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.92 -32.92 74.87 Favored 'General case' 0 C--O 1.205 -1.245 0 O-C-N 120.617 -1.302 . . . . 0.0 110.12 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.21 -41.69 89.17 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 119.952 1.251 . . . . 0.0 109.26 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -62.29 -48.21 80.88 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.81 0.844 . . . . 0.0 109.765 175.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.6 -42.57 99.06 Favored 'General case' 0 C--N 1.359 1.011 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.89 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -64.14 -43.22 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 O-C-N 121.337 -0.852 . . . . 0.0 109.519 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.03 -40.3 95.27 Favored 'General case' 0 C--N 1.363 1.163 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 45.5 ttm -62.85 -49.34 75.27 Favored 'General case' 0 C--N 1.356 0.89 0 CA-C-O 120.884 0.374 . . . . 0.0 111.01 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.23 -45.96 82.56 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 121.457 0.646 . . . . 0.0 109.978 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.4 ttm -62.65 -49.83 73.59 Favored 'General case' 0 C--O 1.217 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.553 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.67 -45.17 96.35 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 121.333 -0.855 . . . . 0.0 113.962 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.472 ' HB3' HG13 ' A' ' 48' ' ' VAL . 59.9 m-85 -86.82 -37.8 17.44 Favored 'General case' 0 C--N 1.358 0.947 0 CA-C-N 119.436 1.618 . . . . 0.0 113.008 -176.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -81.37 -50.7 9.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 120.507 -1.37 . . . . 0.0 111.877 -176.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -64.87 -42.58 94.72 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.4 mtp -84.01 -22.44 31.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.886 -1.134 . . . . 0.0 110.803 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 59.91 37.81 21.4 Favored 'General case' 0 C--N 1.369 1.425 0 CA-C-O 122.255 1.026 . . . . 0.0 110.921 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -127.83 145.88 50.79 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.591 -1.186 . . . . 0.0 108.405 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.1 t -89.06 -4.35 58.39 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.62 107.92 16.38 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -85.39 151.75 56.77 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.19 140.16 76.26 Favored 'Trans proline' 0 N--CA 1.472 0.256 0 C-N-CA 121.544 1.496 . . . . 0.0 113.37 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -37.08 93.54 Favored Glycine 0 C--N 1.357 1.725 0 O-C-N 121.88 -0.513 . . . . 0.0 112.417 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.73 -29.55 65.84 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.508 1.154 . . . . 0.0 109.69 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -72.78 -37.75 67.51 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -71.35 -24.75 62.16 Favored 'General case' 0 C--N 1.367 1.344 0 O-C-N 121.818 -0.551 . . . . 0.0 110.401 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.23 -46.5 90.17 Favored 'General case' 0 C--N 1.359 0.979 0 CA-C-O 121.953 0.882 . . . . 0.0 109.501 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -65.59 -39.58 91.73 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.748 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -43.67 77.64 Favored 'General case' 0 C--N 1.363 1.183 0 O-C-N 121.799 -0.563 . . . . 0.0 110.575 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.88 -41.25 83.08 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 122.766 0.426 . . . . 0.0 110.094 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.929 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 -179.736 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 . . . . . 0 CA--C 1.518 -0.283 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.2 tt -57.15 -24.68 21.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.352 0 C-N-CA 123.864 0.866 . . . . 0.0 112.648 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.29 -15.14 63.45 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 121.67 -0.643 . . . . 0.0 110.739 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -89.4 -5.68 57.23 Favored 'General case' 0 C--N 1.361 1.083 0 O-C-N 121.623 -0.673 . . . . 0.0 109.555 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -101.67 -104.14 0.26 Allowed 'General case' 0 C--N 1.35 0.609 0 CA-C-O 122.089 0.947 . . . . 0.0 109.108 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.591 HG22 ' HD2' ' A' ' 8' ' ' PRO . 3.3 p -89.93 153.99 47.44 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.591 ' HD2' HG22 ' A' ' 7' ' ' VAL . 71.5 Cg_exo -56.78 126.56 22.64 Favored 'Trans proline' 0 C--N 1.349 0.584 0 CA-C-N 119.635 0.905 . . . . 0.0 111.259 175.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.26 119.05 24.09 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.399 1.571 . . . . 0.0 112.563 -175.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -84.1 164.79 42.26 Favored Pre-proline 0 N--CA 1.439 -0.99 0 CA-C-N 112.954 -1.93 . . . . 0.0 106.036 175.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -55.52 -26.94 57.01 Favored 'Trans proline' 0 N--CA 1.486 1.066 0 C-N-CA 122.133 1.888 . . . . 0.0 113.031 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.65 -51.07 25.02 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 124.498 1.119 . . . . 0.0 108.954 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.36 81.58 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.031 1.332 . . . . 0.0 111.04 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 45.6 t -61.26 -44.03 97.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.049 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 67.5 m -72.42 -36.66 68.64 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.919 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.57 -41.04 69.53 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 121.522 -0.736 . . . . 0.0 110.68 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.429 ' CD1' HD21 ' A' ' 34' ' ' LEU . 72.9 t80 -66.23 -36.07 82.08 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.0 m -52.58 -54.76 39.18 Favored Pre-proline 0 N--CA 1.487 1.424 0 N-CA-C 114.714 1.375 . . . . 0.0 114.714 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 CA--C 1.516 -0.419 0 CA-C-N 121.486 1.567 . . . . 0.0 114.542 179.212 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 . . . . . 0 N--CA 1.468 0.436 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.43 -56.11 38.53 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.13 -18.12 24.05 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 CA-C-N 121.201 1.465 . . . . 0.0 114.508 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -70.17 -37.26 75.12 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.32 -24.22 57.38 Favored 'General case' 0 C--N 1.359 1.015 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.69 -178.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.429 HD21 ' CD1' ' A' ' 17' ' ' TYR . 94.0 mt -66.83 -38.58 86.7 Favored 'General case' 0 C--N 1.363 1.172 0 O-C-N 121.558 -0.714 . . . . 0.0 109.846 179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.0 t -65.77 -41.12 92.43 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.852 HD13 HD11 ' A' ' 42' ' ' ILE . 80.2 mt -64.59 -39.95 94.65 Favored 'General case' 0 C--N 1.36 1.054 0 O-C-N 121.499 -0.751 . . . . 0.0 109.446 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.62 -21.04 15.83 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.146 1.378 . . . . 0.0 112.647 178.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -70.13 -17.55 63.2 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.262 -0.899 . . . . 0.0 111.014 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.97 5.2 7.59 Favored Glycine 0 C--N 1.359 1.827 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.9 t -69.29 -44.09 72.51 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.272 1.036 . . . . 0.0 109.099 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 67.79 178.27 0.24 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.591 0.71 . . . . 0.0 110.54 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.852 HD11 HD13 ' A' ' 36' ' ' LEU . 2.6 mp -135.08 123.11 39.18 Favored 'Isoleucine or valine' 0 C--N 1.358 0.954 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -150.42 126.67 10.66 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 103.272 -2.862 . . . . 0.0 103.272 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.65 -168.91 40.2 Favored Glycine 0 CA--C 1.493 -1.335 0 N-CA-C 108.292 -1.923 . . . . 0.0 108.292 -178.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.6 p -121.45 114.51 21.37 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.52 134.27 35.13 Favored 'General case' 0 C--N 1.355 0.839 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 118.62 24.12 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.746 1.26 . . . . 0.0 110.326 -176.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.498 HG13 ' HB3' ' A' ' 104' ' ' TYR . 87.2 t -98.9 108.67 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 104.281 -2.489 . . . . 0.0 104.281 176.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -68.9 129.75 40.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 101.74 -8.59 56.42 Favored Glycine 0 C--N 1.361 1.918 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -133.91 -107.45 0.98 Allowed Glycine 0 C--N 1.355 1.601 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.59 158.6 25.28 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 124.38 8.3 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.178 1.252 . . . . 0.0 113.035 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.8 pt -111.12 139.72 33.75 Favored 'Isoleucine or valine' 0 C--N 1.356 0.866 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.4 p -65.9 144.9 56.51 Favored 'General case' 0 C--N 1.365 1.281 0 CA-C-O 121.746 0.784 . . . . 0.0 111.974 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -142.65 143.62 32.43 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.5 t -129.56 129.61 66.81 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.09 133.87 32.15 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -132.26 151.58 51.76 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 122.445 1.117 . . . . 0.0 108.754 -178.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -119.29 124.26 46.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 105.58 -2.008 . . . . 0.0 105.58 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.6 m -155.91 144.64 20.34 Favored 'General case' 0 CA--C 1.493 -1.212 0 N-CA-C 103.933 -2.618 . . . . 0.0 103.933 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 62' ' ' VAL . 0.7 OUTLIER -69.57 100.97 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-O 122.432 1.111 . . . . 0.0 110.86 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.76 156.95 34.58 Favored Pre-proline 0 C--N 1.352 0.674 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.69 152.33 1.67 Allowed 'Trans proline' 0 C--O 1.204 -1.216 0 C-N-CA 122.907 2.405 . . . . 0.0 117.029 -177.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.33 -50.9 73.49 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -176.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.07 -5.02 16.27 Favored 'Trans proline' 0 CA--C 1.511 -0.65 0 CA-C-N 121.036 1.406 . . . . 0.0 112.123 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.81 24.65 10.91 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -70.48 68.87 0.38 Allowed 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.557 0.694 . . . . 0.0 110.323 -178.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.1 mtt -124.39 153.93 41.15 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.826 0.822 . . . . 0.0 109.607 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.7 m -94.33 135.61 35.54 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 mtt85 -115.64 129.61 56.56 Favored 'General case' 0 C--N 1.361 1.079 0 CA-C-N 122.167 2.258 . . . . 0.0 109.64 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.4 t -123.33 141.23 52.2 Favored 'General case' 0 C--N 1.353 0.725 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -120.12 124.18 45.17 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -126.33 133.65 51.31 Favored 'General case' 0 C--N 1.355 0.838 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -103.88 139.56 38.89 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -86.24 112.52 21.45 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.662 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.66 25.31 15.05 Favored 'General case' 0 C--N 1.374 1.645 0 C-N-CA 123.717 0.807 . . . . 0.0 110.369 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 66.17 23.82 10.89 Favored 'General case' 0 C--N 1.371 1.509 0 C-N-CA 123.578 0.751 . . . . 0.0 110.693 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -93.44 118.17 30.99 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -18.3 65.23 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -85.59 -4.53 59.19 Favored 'General case' 0 C--N 1.357 0.934 0 O-C-N 121.211 -0.931 . . . . 0.0 109.58 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.06 95.33 4.27 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.3 p -126.05 149.6 48.75 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-O 122.115 0.959 . . . . 0.0 109.353 -176.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -126.42 132.24 51.55 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -120.82 108.29 13.76 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 103.194 -2.891 . . . . 0.0 103.194 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mm -120.51 118.93 58.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.097 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.32 142.21 45.77 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.12 159.75 33.12 Favored Pre-proline 0 C--O 1.239 0.541 0 N-CA-C 105.631 -1.988 . . . . 0.0 105.631 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -52.19 149.26 22.41 Favored 'Trans proline' 0 N--CA 1.484 0.953 0 C-N-CA 122.343 2.028 . . . . 0.0 111.502 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.21 -18.67 59.44 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.633 -1.292 . . . . 0.0 113.727 -174.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -89.7 -22.9 22.0 Favored 'General case' 0 C--N 1.355 0.822 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -94.61 -29.67 14.74 Favored 'General case' 0 C--N 1.357 0.933 0 O-C-N 121.784 -0.573 . . . . 0.0 111.134 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -64.61 -40.79 96.13 Favored 'General case' 0 C--N 1.361 1.082 0 O-C-N 121.944 -0.473 . . . . 0.0 111.857 -176.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.76 -32.83 74.6 Favored 'General case' 0 C--O 1.207 -1.183 0 O-C-N 120.461 -1.4 . . . . 0.0 110.101 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -59.52 -41.31 89.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.136 1.334 . . . . 0.0 108.893 177.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' TYR . . . . . 0.475 ' HE1' HD11 ' A' ' 120' ' ' LEU . 12.5 t80 -63.2 -48.18 79.44 Favored 'General case' 0 C--N 1.351 0.671 0 C-N-CA 123.622 0.769 . . . . 0.0 110.011 175.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -42.48 96.37 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.607 0.363 . . . . 0.0 111.595 -176.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.88 -44.7 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 121.485 -0.759 . . . . 0.0 109.62 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.63 -40.86 96.35 Favored 'General case' 0 C--N 1.363 1.193 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -63.03 -49.21 75.49 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.718 0.407 . . . . 0.0 110.913 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.01 -46.41 78.05 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-O 121.631 0.729 . . . . 0.0 110.247 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttm -62.45 -49.92 73.52 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.942 -178.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.2 -44.29 97.92 Favored Glycine 0 C--N 1.358 1.79 0 CA-C-O 119.371 -0.683 . . . . 0.0 114.11 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' TYR . . . . . 0.498 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.9 m-85 -85.49 -38.13 18.92 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.387 1.594 . . . . 0.0 112.34 -176.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -78.39 -50.09 12.36 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 120.647 -1.283 . . . . 0.0 111.975 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -66.24 -42.34 88.75 Favored 'General case' 0 C--N 1.357 0.896 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 86.8 mtp -86.33 -22.55 26.64 Favored 'General case' 0 C--N 1.367 1.337 0 O-C-N 120.743 -1.223 . . . . 0.0 110.703 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 62.61 32.51 16.31 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-O 122.067 0.937 . . . . 0.0 111.148 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -114.41 141.74 47.27 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.3 t -86.7 -9.05 56.81 Favored 'General case' 0 C--N 1.362 1.144 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -88.41 121.99 31.42 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -87.76 153.31 52.42 Favored Pre-proline 0 C--N 1.348 0.537 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -63.17 142.1 85.46 Favored 'Trans proline' 0 CA--C 1.519 -0.249 0 C-N-CA 121.611 1.541 . . . . 0.0 113.18 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.89 -38.28 95.74 Favored Glycine 0 C--N 1.357 1.701 0 O-C-N 121.82 -0.55 . . . . 0.0 112.585 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.65 -28.6 63.87 Favored 'General case' 0 C--N 1.36 1.043 0 CA-C-N 118.723 1.262 . . . . 0.0 109.652 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -72.65 -34.11 67.04 Favored 'General case' 0 C--N 1.356 0.881 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -73.56 -24.24 60.07 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 121.194 -0.941 . . . . 0.0 110.378 -179.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -61.98 -49.94 74.08 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-O 121.378 0.608 . . . . 0.0 111.314 -178.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.05 -23.96 63.18 Favored 'General case' 0 C--N 1.363 1.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.065 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.475 HD11 ' HE1' ' A' ' 96' ' ' TYR . 5.2 mp -84.04 -42.19 16.42 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.571 -0.706 . . . . 0.0 109.33 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.0 tp -68.21 -40.45 82.14 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 2.226 0 N-CA-C 110.236 -1.146 . . . . 0.0 110.236 179.2 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.8 mtm . . . . . 0 N--CA 1.502 2.146 0 CA-C-O 121.635 0.731 . . . . 0.0 111.435 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -142.82 162.6 35.04 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-O 121.992 0.901 . . . . 0.0 109.666 -178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.76 -19.41 25.36 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 CA-C-N 115.394 -0.821 . . . . 0.0 112.796 -178.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -72.95 -11.08 60.44 Favored 'General case' 0 C--N 1.362 1.143 0 O-C-N 121.139 -0.976 . . . . 0.0 110.671 -178.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -93.15 -6.41 47.95 Favored 'General case' 0 C--N 1.359 0.987 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.5 mt -103.87 -114.58 0.23 Allowed 'General case' 0 C--N 1.353 0.722 0 CA-C-O 121.942 0.877 . . . . 0.0 109.102 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.723 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -89.52 158.05 46.24 Favored Pre-proline 0 C--N 1.345 0.39 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.723 ' HD2' HG22 ' A' ' 7' ' ' VAL . 85.3 Cg_exo -54.82 129.0 32.81 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 120.795 0.996 . . . . 0.0 112.181 176.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.92 117.0 14.1 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-O 123.415 1.579 . . . . 0.0 112.631 -175.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -85.8 160.91 51.92 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 105.807 -1.923 . . . . 0.0 105.807 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -60.42 -23.6 75.33 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 121.467 1.445 . . . . 0.0 113.01 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -73.12 -47.87 40.52 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-O 122.392 1.091 . . . . 0.0 108.601 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.35 93.32 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 125.07 1.348 . . . . 0.0 110.778 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.8 t -61.56 -44.36 98.5 Favored 'Isoleucine or valine' 0 C--N 1.353 0.718 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.962 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.2 p -73.21 -33.42 65.36 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 119.076 -1.05 . . . . 0.0 111.671 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.44 -38.93 71.29 Favored 'General case' 0 C--N 1.361 1.07 0 O-C-N 121.272 -0.893 . . . . 0.0 110.285 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.465 ' CD1' HD21 ' A' ' 34' ' ' LEU . 71.3 t80 -79.54 -13.64 59.4 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 121.921 -0.487 . . . . 0.0 111.742 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 17.5 m -59.19 -51.81 79.02 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 120.636 -1.29 . . . . 0.0 114.121 -177.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -66.95 124.7 12.59 Favored 'Trans proline' 0 C--N 1.349 0.572 0 CA-C-N 121.551 1.59 . . . . 0.0 114.683 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -104.89 101.86 11.42 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -83.0 128.79 34.8 Favored 'General case' 0 C--N 1.351 0.671 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 33.9 t -155.1 148.19 24.74 Favored 'General case' 0 C--N 1.353 0.755 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -109.76 -1.56 17.88 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -157.27 -73.51 0.09 Allowed 'General case' 0 C--N 1.363 1.172 0 O-C-N 121.258 -0.901 . . . . 0.0 109.183 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -137.0 -76.75 0.41 Allowed 'General case' 0 C--N 1.356 0.884 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -101.44 157.11 17.04 Favored 'General case' 0 C--N 1.354 0.771 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -140.87 128.17 21.05 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -68.6 -14.9 63.32 Favored 'General case' 0 C--N 1.357 0.923 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.52 -39.66 81.09 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 120.904 -1.122 . . . . 0.0 112.179 -177.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.9 tp -64.04 -54.68 38.19 Favored Pre-proline 0 C--N 1.361 1.104 0 O-C-N 121.326 -0.859 . . . . 0.0 112.82 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.97 -22.4 42.03 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 121.02 1.4 . . . . 0.0 114.506 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -70.86 -38.36 73.15 Favored 'General case' 0 C--N 1.363 1.153 0 N-CA-C 107.225 -1.398 . . . . 0.0 107.225 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.9 -33.49 68.37 Favored 'General case' 0 C--N 1.365 1.272 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.465 HD21 ' CD1' ' A' ' 17' ' ' TYR . 80.1 mt -63.46 -39.47 94.55 Favored 'General case' 0 C--N 1.368 1.411 0 O-C-N 121.644 -0.66 . . . . 0.0 109.529 178.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.7 m -64.07 -40.31 95.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.469 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.81 HD13 HD11 ' A' ' 42' ' ' ILE . 59.2 mt -69.04 -39.73 79.02 Favored 'General case' 0 C--N 1.361 1.077 0 CA-C-O 121.094 0.474 . . . . 0.0 110.016 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -51.78 -23.7 4.99 Favored 'General case' 0 C--N 1.364 1.233 0 C-N-CA 125.651 1.58 . . . . 0.0 113.408 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -66.91 -19.82 65.8 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.509 -0.744 . . . . 0.0 111.497 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 130.03 -0.69 5.74 Favored Glycine 0 C--N 1.359 1.844 0 N-CA-C 110.451 -1.06 . . . . 0.0 110.451 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 67.3 m -66.64 -41.83 87.67 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 118.28 1.04 . . . . 0.0 109.515 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 m 65.72 177.91 0.21 Allowed 'General case' 0 C--N 1.375 1.678 0 CA-C-O 121.676 0.751 . . . . 0.0 110.848 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.81 HD11 HD13 ' A' ' 36' ' ' LEU . 3.0 mp -132.59 126.8 55.45 Favored 'Isoleucine or valine' 0 C--N 1.359 0.98 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -154.99 133.65 12.03 Favored 'General case' 0 N--CA 1.433 -1.286 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 174.05 -170.22 43.33 Favored Glycine 0 CA--C 1.491 -1.425 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 50.3 m -120.69 114.45 21.69 Favored 'General case' 0 CA--C 1.503 -0.851 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -91.53 129.07 37.57 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.21 123.15 27.68 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.915 1.341 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.563 HG13 ' HB3' ' A' ' 104' ' ' TYR . 92.7 t -107.2 116.47 50.93 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.24 0 N-CA-C 104.252 -2.499 . . . . 0.0 104.252 177.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -72.33 136.69 46.27 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.589 0.709 . . . . 0.0 109.39 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.28 -8.1 62.4 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 110.277 -1.129 . . . . 0.0 110.277 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -138.8 -104.15 0.61 Allowed Glycine 0 C--N 1.354 1.561 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.14 159.16 21.37 Favored Pre-proline 0 N--CA 1.448 -0.562 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.7 124.01 7.88 Favored 'Trans proline' 0 CA--C 1.515 -0.466 0 C-N-CA 121.341 1.361 . . . . 0.0 112.818 178.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.52 136.15 45.07 Favored 'Isoleucine or valine' 0 C--N 1.358 0.939 0 CA-C-O 122.244 1.021 . . . . 0.0 108.927 -178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 57.8 m -65.02 141.47 58.75 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.165 0.983 . . . . 0.0 112.276 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -141.06 144.42 34.94 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 54.8 t -130.38 131.79 65.17 Favored 'Isoleucine or valine' 0 C--N 1.355 0.805 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.54 134.3 33.72 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 105.979 -1.859 . . . . 0.0 105.979 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.7 m -131.16 132.21 44.59 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 122.19 0.995 . . . . 0.0 109.099 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 49.9 m95 -113.97 132.15 56.07 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.8 t -164.17 179.19 7.05 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -77.91 99.93 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.297 0 CA-C-O 122.628 1.204 . . . . 0.0 109.383 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.8 t -100.59 144.53 28.67 Favored Pre-proline 0 C--N 1.354 0.779 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -49.37 149.71 8.98 Favored 'Trans proline' 0 CA--C 1.501 -1.136 0 C-N-CA 122.526 2.15 . . . . 0.0 116.334 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 31.0 tp -46.72 -51.06 40.12 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.27 -6.35 17.11 Favored 'Trans proline' 0 C--N 1.353 0.778 0 CA-C-N 121.44 1.55 . . . . 0.0 112.425 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.25 27.23 9.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.898 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -68.54 64.8 0.11 Allowed 'General case' 0 C--N 1.381 1.957 0 CA-C-O 121.252 0.549 . . . . 0.0 110.582 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.2 mtt -125.02 152.87 43.68 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.784 0.802 . . . . 0.0 108.966 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.7 m -95.92 132.86 40.76 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -109.99 131.91 54.63 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 122.194 2.27 . . . . 0.0 109.824 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.5 t -125.08 137.45 54.2 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -115.18 125.33 53.28 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.3 129.33 47.49 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.09 138.87 39.35 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -86.02 112.3 21.1 Favored 'General case' 0 C--N 1.349 0.575 0 O-C-N 121.266 -0.896 . . . . 0.0 109.205 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.1 t30 63.83 26.69 14.41 Favored 'General case' 0 C--N 1.372 1.569 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.131 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 64.93 24.19 12.66 Favored 'General case' 0 C--N 1.371 1.537 0 C-N-CA 123.529 0.732 . . . . 0.0 110.895 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.63 116.15 28.75 Favored 'General case' 0 C--N 1.352 0.709 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.59 -25.38 68.05 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -75.79 -14.15 60.3 Favored 'General case' 0 C--N 1.362 1.151 0 O-C-N 121.195 -0.941 . . . . 0.0 109.613 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.9 mt -116.94 85.6 2.35 Favored 'General case' 0 CA--C 1.508 -0.64 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.3 m -120.36 130.19 54.29 Favored 'General case' 0 C--N 1.361 1.106 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -109.17 132.3 54.24 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -118.5 107.88 14.32 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 103.159 -2.904 . . . . 0.0 103.159 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.8 mm -118.87 118.96 59.53 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.191 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.97 141.97 46.36 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -150.08 160.14 34.05 Favored Pre-proline 0 CA--C 1.51 -0.564 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.31 150.38 15.01 Favored 'Trans proline' 0 N--CA 1.485 0.979 0 C-N-CA 122.16 1.907 . . . . 0.0 111.716 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -62.7 -19.18 63.63 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 120.323 -1.486 . . . . 0.0 113.728 -174.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.0 t60 -89.1 -24.58 22.23 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -92.45 -29.34 16.31 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 123.124 0.57 . . . . 0.0 111.137 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.68 -39.82 94.32 Favored 'General case' 0 C--N 1.359 0.992 0 O-C-N 122.035 -0.416 . . . . 0.0 111.905 -176.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -63.97 -37.53 87.74 Favored 'General case' 0 C--N 1.359 0.995 0 O-C-N 120.447 -1.408 . . . . 0.0 110.269 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.8 mm-40 -58.16 -41.36 83.63 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 120.271 1.396 . . . . 0.0 109.593 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -61.19 -48.3 82.18 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 109.952 175.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.92 -41.54 91.97 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.762 -176.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.72 -45.45 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 O-C-N 121.429 -0.794 . . . . 0.0 109.59 179.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.82 -40.8 98.49 Favored 'General case' 0 C--N 1.36 1.049 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.125 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -62.65 -47.65 82.79 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 122.635 0.374 . . . . 0.0 110.728 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.1 mt -66.12 -44.94 82.85 Favored 'General case' 0 C--N 1.36 1.058 0 CA-C-O 121.446 0.641 . . . . 0.0 109.864 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.5 ttt -61.81 -48.73 79.3 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.482 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.14 -46.66 92.75 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 121.282 -0.886 . . . . 0.0 113.617 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.563 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.2 m-85 -88.15 -39.22 14.71 Favored 'General case' 0 C--N 1.36 1.053 0 CA-C-N 119.328 1.564 . . . . 0.0 113.793 -176.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -83.86 -53.38 5.64 Favored 'General case' 0 C--N 1.354 0.787 0 O-C-N 120.29 -1.507 . . . . 0.0 111.983 -176.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -62.84 -40.78 98.49 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.3 mmt -85.41 -20.69 29.45 Favored 'General case' 0 C--N 1.363 1.178 0 O-C-N 121.017 -1.052 . . . . 0.0 110.833 -176.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 60.03 53.78 4.46 Favored 'General case' 0 C--N 1.366 1.316 0 CA-C-O 122.387 1.089 . . . . 0.0 111.835 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.73 155.36 38.14 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.5 m -109.85 55.53 0.64 Allowed 'General case' 0 C--N 1.364 1.237 0 CA-C-O 122.127 0.965 . . . . 0.0 108.677 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -132.49 115.34 15.38 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 106.449 -1.685 . . . . 0.0 106.449 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -85.4 144.72 40.98 Favored Pre-proline 0 C--N 1.35 0.622 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -63.77 143.79 87.24 Favored 'Trans proline' 0 CA--C 1.518 -0.28 0 C-N-CA 121.48 1.453 . . . . 0.0 112.793 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.89 96.54 Favored Glycine 0 C--N 1.355 1.627 0 O-C-N 121.743 -0.598 . . . . 0.0 112.906 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -73.17 -28.32 62.15 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.903 1.351 . . . . 0.0 109.681 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -73.34 -36.53 66.18 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -70.6 -23.14 62.51 Favored 'General case' 0 C--N 1.365 1.279 0 O-C-N 121.909 -0.494 . . . . 0.0 110.369 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -61.83 -47.0 87.03 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-O 122.189 0.995 . . . . 0.0 109.345 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 -66.31 -39.32 89.21 Favored 'General case' 0 C--N 1.358 0.943 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.649 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.07 -43.4 78.66 Favored 'General case' 0 C--N 1.364 1.203 0 O-C-N 121.826 -0.546 . . . . 0.0 110.332 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.9 tp -66.58 -40.87 89.16 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 93.17 41.4 4.58 Favored Glycine 0 C--N 1.362 1.976 0 N-CA-C 108.628 -1.789 . . . . 0.0 108.628 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -100.67 115.79 31.06 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 -179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -86.61 95.83 9.9 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.268 2.042 0 CA-C-O 118.084 -0.96 . . . . 0.0 109.57 179.229 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ttt . . . . . 0 N--CA 1.504 2.266 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.433 ' HG2' ' H ' ' A' ' 4' ' ' ASP . 57.1 ttp180 -109.0 133.67 52.68 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.2 pt -61.73 -20.66 23.9 Favored 'Isoleucine or valine' 0 C--N 1.365 1.272 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.433 ' H ' ' HG2' ' A' ' 2' ' ' ARG . 98.4 m-20 -74.08 -9.91 59.09 Favored 'General case' 0 C--N 1.362 1.13 0 O-C-N 121.373 -0.829 . . . . 0.0 110.248 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -90.29 -6.9 54.61 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 80.7 mt -106.84 -108.67 0.31 Allowed 'General case' 0 C--N 1.352 0.701 0 CA-C-O 122.099 0.952 . . . . 0.0 109.253 -178.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.4 p -89.62 152.49 47.13 Favored Pre-proline 0 C--O 1.236 0.389 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -57.68 125.99 20.44 Favored 'Trans proline' 0 C--N 1.348 0.539 0 CA-C-N 119.737 0.942 . . . . 0.0 111.259 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.89 120.09 23.0 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 123.251 1.501 . . . . 0.0 112.761 -175.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -83.49 162.32 53.84 Favored Pre-proline 0 N--CA 1.443 -0.787 0 CA-C-N 113.388 -1.733 . . . . 0.0 106.403 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -55.79 -24.59 47.49 Favored 'Trans proline' 0 N--CA 1.49 1.295 0 C-N-CA 122.488 2.125 . . . . 0.0 113.692 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 46.6 mtt180 -75.13 -52.25 11.43 Favored 'General case' 0 C--N 1.349 0.555 0 C-N-CA 124.513 1.125 . . . . 0.0 108.289 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.8 77.95 Favored 'General case' 0 C--N 1.367 1.345 0 C-N-CA 125.23 1.412 . . . . 0.0 110.802 176.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -60.96 -44.05 97.26 Favored 'Isoleucine or valine' 0 C--N 1.349 0.565 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.17 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.3 m -72.69 -37.46 67.84 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.79 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -69.71 -40.64 76.17 Favored 'General case' 0 C--N 1.37 1.471 0 O-C-N 121.583 -0.698 . . . . 0.0 110.297 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -71.23 -20.44 62.25 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 179.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.1 m -58.95 -54.84 52.47 Favored Pre-proline 0 N--CA 1.486 1.349 0 O-C-N 120.976 -1.078 . . . . 0.0 113.422 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.8 150.08 38.67 Favored 'Trans proline' 0 C--N 1.348 0.514 0 CA-C-N 121.323 1.508 . . . . 0.0 113.958 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -128.05 -173.24 2.88 Favored 'General case' 0 C--N 1.354 0.788 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -76.59 133.61 39.61 Favored 'General case' 0 C--N 1.357 0.906 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 49.4 m -79.18 59.21 2.71 Favored 'General case' 0 C--N 1.364 1.226 0 O-C-N 121.833 -0.542 . . . . 0.0 110.503 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -128.67 -29.25 2.4 Favored 'General case' 0 C--N 1.349 0.552 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.44 170.94 19.06 Favored 'General case' 0 C--N 1.358 0.963 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -64.05 -38.57 91.57 Favored 'General case' 0 C--N 1.365 1.279 0 N-CA-C 109.803 -0.444 . . . . 0.0 109.803 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -134.4 132.59 39.58 Favored 'General case' 0 C--N 1.354 0.765 0 N-CA-C 104.742 -2.318 . . . . 0.0 104.742 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.25 154.73 42.95 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-O 121.778 0.799 . . . . 0.0 109.918 -177.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 90.4 mmt-85 -66.48 -22.53 66.19 Favored 'General case' 0 C--N 1.361 1.071 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.026 -179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -70.44 -27.55 64.34 Favored 'General case' 0 C--N 1.347 0.471 0 O-C-N 121.788 -0.57 . . . . 0.0 111.286 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.468 ' HB3' ' HD3' ' A' ' 31' ' ' PRO . 46.0 tp -64.96 -56.06 23.34 Favored Pre-proline 0 C--N 1.367 1.331 0 O-C-N 121.367 -0.833 . . . . 0.0 112.431 -178.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 30' ' ' LEU . 37.7 Cg_exo -61.52 -23.08 76.05 Favored 'Trans proline' 0 C--N 1.358 1.047 0 CA-C-N 121.185 1.459 . . . . 0.0 115.09 179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -68.16 -36.26 79.37 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.96 -19.13 60.24 Favored 'General case' 0 C--N 1.361 1.081 0 O-C-N 121.955 -0.466 . . . . 0.0 109.952 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.8 mt -70.77 -20.12 62.64 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 121.378 -0.827 . . . . 0.0 109.821 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.6 m -84.68 -18.25 35.92 Favored 'General case' 0 C--N 1.351 0.657 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.717 HD13 HD11 ' A' ' 42' ' ' ILE . 70.0 mt -88.38 -43.79 11.24 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -55.61 -25.68 39.95 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 124.466 1.106 . . . . 0.0 113.07 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.21 -10.5 54.9 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 121.444 -0.785 . . . . 0.0 111.892 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.58 5.64 11.03 Favored Glycine 0 C--N 1.375 2.703 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 m -71.17 -43.03 68.29 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 118.259 1.029 . . . . 0.0 109.293 178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.6 t 67.33 179.77 0.22 Allowed 'General case' 0 C--N 1.374 1.656 0 CA-C-O 121.592 0.71 . . . . 0.0 110.712 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.717 HD11 HD13 ' A' ' 36' ' ' LEU . 3.0 mp -136.09 125.16 38.63 Favored 'Isoleucine or valine' 0 C--N 1.358 0.972 0 N-CA-C 107.408 -1.331 . . . . 0.0 107.408 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -150.98 127.39 10.69 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 103.285 -2.857 . . . . 0.0 103.285 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -179.83 -172.36 43.77 Favored Glycine 0 CA--C 1.493 -1.313 0 N-CA-C 108.539 -1.824 . . . . 0.0 108.539 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 51.1 m -121.09 115.72 23.63 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -95.72 132.47 40.88 Favored 'General case' 0 C--N 1.355 0.812 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.91 119.25 22.52 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-O 122.663 1.22 . . . . 0.0 110.146 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.506 HG13 ' HB3' ' A' ' 104' ' ' TYR . 91.6 t -101.21 115.56 43.15 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.145 0 N-CA-C 104.334 -2.469 . . . . 0.0 104.334 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -70.61 136.56 49.26 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -178.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.52 -6.1 57.36 Favored Glycine 0 C--N 1.359 1.839 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.1 -103.38 0.4 Allowed Glycine 0 C--N 1.355 1.604 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.12 160.87 24.46 Favored Pre-proline 0 N--CA 1.448 -0.563 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -177.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -73.9 126.17 10.46 Favored 'Trans proline' 0 CA--C 1.513 -0.528 0 C-N-CA 121.353 1.369 . . . . 0.0 113.403 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 2.7 pt -109.47 137.42 41.69 Favored 'Isoleucine or valine' 0 C--N 1.357 0.913 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 59.7 m -65.84 143.93 57.16 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-O 122.078 0.942 . . . . 0.0 111.466 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 25.0 p90 -140.92 144.42 35.17 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.9 t -129.2 131.96 67.32 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.8 0 N-CA-C 106.486 -1.672 . . . . 0.0 106.486 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.64 130.15 29.63 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.5 m -128.12 131.09 49.01 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.505 1.145 . . . . 0.0 109.554 -177.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -110.95 124.36 51.98 Favored 'General case' 0 C--N 1.354 0.791 0 N-CA-C 104.576 -2.379 . . . . 0.0 104.576 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 91.5 m -152.01 147.56 26.66 Favored 'General case' 0 CA--C 1.488 -1.413 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -71.19 100.98 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.347 0 CA-C-O 122.694 1.235 . . . . 0.0 110.765 -179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 17.7 p -99.87 161.86 22.97 Favored Pre-proline 0 C--N 1.354 0.767 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 178.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -51.29 153.78 9.22 Favored 'Trans proline' 0 C--O 1.206 -1.122 0 C-N-CA 122.151 1.9 . . . . 0.0 115.721 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.6 tp -46.45 -54.31 19.2 Favored Pre-proline 0 CA--C 1.549 0.918 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -74.1 -6.9 19.18 Favored 'Trans proline' 0 C--N 1.353 0.77 0 CA-C-N 121.321 1.507 . . . . 0.0 112.946 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.35 24.97 10.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.333 -0.849 . . . . 0.0 108.962 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -73.63 68.91 1.24 Allowed 'General case' 0 C--N 1.379 1.877 0 CA-C-O 121.927 0.87 . . . . 0.0 109.471 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.7 mtt -120.5 154.11 35.73 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.916 0.865 . . . . 0.0 109.896 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 79.3 m -96.33 137.03 36.0 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 105.44 -2.059 . . . . 0.0 105.44 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 -112.69 130.16 56.15 Favored 'General case' 0 C--N 1.36 1.057 0 CA-C-N 122.261 2.301 . . . . 0.0 109.385 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.5 t -123.36 138.77 54.53 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -120.07 125.25 47.84 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.6 mt -128.43 140.24 51.94 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.5 pm0 -127.97 142.9 51.11 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 106.043 -1.836 . . . . 0.0 106.043 178.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -91.1 124.2 35.14 Favored 'General case' 0 C--N 1.349 0.586 0 O-C-N 121.534 -0.729 . . . . 0.0 110.793 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 60.87 24.15 14.15 Favored 'General case' 0 C--N 1.374 1.649 0 C-N-CA 124.176 0.99 . . . . 0.0 110.995 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 63.38 26.89 15.15 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 123.344 0.658 . . . . 0.0 110.534 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -93.11 122.36 35.4 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.76 -16.16 63.72 Favored 'General case' 0 C--N 1.352 0.698 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -88.0 -2.88 58.88 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 120.863 -1.148 . . . . 0.0 109.466 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.2 mt -124.05 94.87 4.35 Favored 'General case' 0 CA--C 1.5 -0.949 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 -178.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 74.2 p -128.67 151.05 49.96 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-O 121.755 0.788 . . . . 0.0 109.174 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -137.4 132.52 33.6 Favored 'General case' 0 CA--C 1.492 -1.256 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.83 111.62 18.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 103.489 -2.782 . . . . 0.0 103.489 177.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.8 mm -119.3 117.82 55.38 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.985 0 N-CA-C 105.418 -2.068 . . . . 0.0 105.418 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.2 139.63 44.67 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -152.92 162.64 25.87 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -52.55 149.27 24.56 Favored 'Trans proline' 0 N--CA 1.488 1.196 0 C-N-CA 122.389 2.059 . . . . 0.0 112.298 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -59.52 -19.82 50.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.964 -1.085 . . . . 0.0 113.814 -174.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -88.77 -45.58 9.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -71.53 -35.45 70.69 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.197 0.599 . . . . 0.0 111.068 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.9 t80 -62.72 -38.99 92.67 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 123.033 0.533 . . . . 0.0 111.673 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 pp -66.03 -26.38 67.49 Favored 'General case' 0 C--O 1.207 -1.18 0 O-C-N 120.286 -1.509 . . . . 0.0 110.619 -177.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -63.99 -40.77 97.14 Favored 'General case' 0 C--N 1.374 1.647 0 CA-C-N 119.993 1.27 . . . . 0.0 108.585 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -61.99 -47.11 86.29 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 123.935 0.894 . . . . 0.0 109.507 175.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.1 tp -60.89 -42.69 98.48 Favored 'General case' 0 C--N 1.357 0.929 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.739 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -45.95 97.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.416 -0.803 . . . . 0.0 109.653 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.71 -41.25 99.05 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.481 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 66.4 ttp -63.07 -48.7 77.5 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 122.686 0.394 . . . . 0.0 111.092 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -66.35 -45.95 78.44 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-O 121.604 0.716 . . . . 0.0 109.9 -178.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.85 -50.33 71.35 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.157 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.12 -45.1 97.23 Favored Glycine 0 C--N 1.359 1.83 0 CA-C-O 119.123 -0.821 . . . . 0.0 115.112 -174.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.506 ' HB3' HG13 ' A' ' 48' ' ' VAL . 76.4 m-85 -84.57 -33.59 23.38 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-N 119.827 1.813 . . . . 0.0 111.867 -176.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -82.13 -49.52 10.07 Favored 'General case' 0 C--N 1.349 0.574 0 O-C-N 120.851 -1.156 . . . . 0.0 111.672 -177.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -64.54 -43.82 92.75 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -176.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -85.22 -22.08 28.83 Favored 'General case' 0 C--N 1.367 1.33 0 O-C-N 120.684 -1.26 . . . . 0.0 110.704 -176.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 61.46 40.84 13.41 Favored 'General case' 0 C--N 1.367 1.364 0 CA-C-O 122.434 1.112 . . . . 0.0 110.461 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -125.46 147.57 49.16 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.386 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 32.4 p -91.06 -10.86 40.58 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -81.99 118.75 23.23 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -85.48 151.39 55.98 Favored Pre-proline 0 C--N 1.347 0.491 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -62.53 141.12 85.2 Favored 'Trans proline' 0 N--CA 1.473 0.322 0 C-N-CA 121.508 1.472 . . . . 0.0 113.078 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.6 -38.94 96.68 Favored Glycine 0 C--N 1.356 1.667 0 O-C-N 121.934 -0.478 . . . . 0.0 112.827 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -72.24 -29.45 63.95 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 118.811 1.305 . . . . 0.0 109.654 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -72.93 -35.32 67.0 Favored 'General case' 0 C--N 1.354 0.765 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -70.75 -22.46 62.4 Favored 'General case' 0 C--N 1.364 1.197 0 O-C-N 121.795 -0.566 . . . . 0.0 110.177 -178.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.6 ttp180 -62.74 -45.77 91.16 Favored 'General case' 0 C--N 1.364 1.223 0 CA-C-O 122.136 0.969 . . . . 0.0 108.964 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.89 -40.21 96.85 Favored 'General case' 0 C--N 1.361 1.099 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.809 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.62 -43.45 69.24 Favored 'General case' 0 C--N 1.358 0.978 0 O-C-N 122.065 -0.397 . . . . 0.0 110.385 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 55.6 tp -66.93 -40.67 87.66 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.834 0.454 . . . . 0.0 110.272 -179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.4 26.87 29.2 Favored Glycine 0 C--N 1.364 2.121 0 N-CA-C 110.039 -1.224 . . . . 0.0 110.039 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -97.81 116.37 29.88 Favored 'General case' 0 C--N 1.35 0.623 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -82.9 96.17 8.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 -179.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 C--O 1.271 2.192 0 CA-C-O 118.101 -0.952 . . . . 0.0 109.057 178.628 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 tpp . . . . . 0 N--CA 1.504 2.247 0 CA-C-O 121.339 0.59 . . . . 0.0 111.815 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.7 ptt-85 -149.39 163.61 37.26 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.9 pt -63.49 -21.59 28.83 Favored 'Isoleucine or valine' 0 C--N 1.364 1.21 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -79.44 -8.92 59.46 Favored 'General case' 0 C--N 1.357 0.895 0 O-C-N 121.083 -1.011 . . . . 0.0 111.041 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -101.79 -1.62 31.93 Favored 'General case' 0 C--N 1.36 1.029 0 O-C-N 121.599 -0.688 . . . . 0.0 109.499 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.9 mt -102.77 -120.45 0.19 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-O 121.966 0.888 . . . . 0.0 108.785 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.719 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -89.23 158.43 46.49 Favored Pre-proline 0 C--N 1.347 0.459 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 179.551 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.719 ' HD2' HG22 ' A' ' 7' ' ' VAL . 88.6 Cg_exo -53.99 126.59 22.52 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 120.821 1.014 . . . . 0.0 112.617 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.07 118.8 18.42 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 123.2 1.476 . . . . 0.0 112.067 -176.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -84.24 160.74 56.59 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-N 113.372 -1.74 . . . . 0.0 106.909 176.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.08 -19.03 61.46 Favored 'Trans proline' 0 N--CA 1.486 1.072 0 C-N-CA 122.039 1.826 . . . . 0.0 113.416 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 mmt85 -76.5 -53.07 8.6 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.19 -46.59 79.33 Favored 'General case' 0 C--N 1.366 1.324 0 C-N-CA 125.436 1.495 . . . . 0.0 110.823 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -60.96 -42.67 93.77 Favored 'Isoleucine or valine' 0 C--N 1.349 0.576 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.9 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.3 m -71.52 -36.56 71.07 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.385 -176.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.2 mt -70.51 -40.67 73.37 Favored 'General case' 0 C--N 1.369 1.414 0 O-C-N 121.656 -0.652 . . . . 0.0 110.323 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -72.42 -22.14 61.15 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -59.34 -54.58 54.78 Favored Pre-proline 0 N--CA 1.485 1.325 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.55 155.23 40.4 Favored 'Trans proline' 0 C--N 1.349 0.56 0 CA-C-N 121.308 1.503 . . . . 0.0 114.266 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.4 p90 -155.28 158.87 39.47 Favored 'General case' 0 C--N 1.35 0.626 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -91.95 67.78 5.24 Favored 'General case' 0 C--N 1.357 0.926 0 CA-C-O 121.327 0.584 . . . . 0.0 109.748 -178.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.7 t -162.5 152.48 16.3 Favored 'General case' 0 C--N 1.351 0.651 0 N-CA-C 106.668 -1.605 . . . . 0.0 106.668 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -79.37 -19.84 49.2 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -157.92 154.34 27.71 Favored 'General case' 0 C--N 1.356 0.88 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.6 t30 67.6 -121.23 0.22 Allowed 'General case' 0 C--N 1.366 1.306 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 41.8 ptt180 -160.34 163.41 33.29 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -106.87 171.18 7.51 Favored 'General case' 0 C--N 1.356 0.864 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -60.32 -27.69 67.53 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 123.726 0.81 . . . . 0.0 112.217 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -69.07 -27.7 65.86 Favored 'General case' 0 C--N 1.349 0.582 0 O-C-N 121.807 -0.558 . . . . 0.0 111.783 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.0 tp -67.14 -56.02 14.33 Favored Pre-proline 0 C--N 1.365 1.245 0 O-C-N 121.238 -0.914 . . . . 0.0 112.9 -177.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -70.99 -18.31 31.33 Favored 'Trans proline' 0 C--N 1.356 0.974 0 CA-C-N 121.112 1.433 . . . . 0.0 114.046 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -69.41 -36.1 76.41 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.56 -18.48 59.74 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.932 -178.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.91 -36.18 82.67 Favored 'General case' 0 C--N 1.362 1.11 0 O-C-N 121.412 -0.805 . . . . 0.0 108.905 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -64.27 -38.25 90.36 Favored 'General case' 0 N--CA 1.473 0.725 0 O-C-N 122.001 -0.437 . . . . 0.0 110.044 177.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.573 ' CD2' HD11 ' A' ' 42' ' ' ILE . 7.5 mp -68.31 -43.98 76.42 Favored 'General case' 0 C--N 1.363 1.158 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 179.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -55.01 -28.42 51.93 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 124.763 1.225 . . . . 0.0 112.602 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -65.09 -19.94 66.23 Favored 'General case' 0 C--N 1.361 1.099 0 O-C-N 121.257 -0.902 . . . . 0.0 111.064 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 119.23 11.21 7.58 Favored Glycine 0 C--N 1.36 1.915 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 55.3 m -65.73 -43.84 87.81 Favored 'General case' 0 C--N 1.361 1.088 0 CA-C-N 117.552 0.676 . . . . 0.0 109.437 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.9 m 65.28 173.94 0.21 Allowed 'General case' 0 C--N 1.375 1.675 0 CA-C-O 121.969 0.89 . . . . 0.0 111.356 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.573 HD11 ' CD2' ' A' ' 36' ' ' LEU . 2.7 mp -136.24 127.06 42.37 Favored 'Isoleucine or valine' 0 C--N 1.36 1.024 0 N-CA-C 106.657 -1.608 . . . . 0.0 106.657 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -151.47 126.03 9.52 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 103.187 -2.894 . . . . 0.0 103.187 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.75 -169.19 41.08 Favored Glycine 0 CA--C 1.492 -1.367 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 p -121.54 115.9 23.67 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.1 tpt180 -92.56 130.45 38.2 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.85 118.49 22.41 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 122.874 1.321 . . . . 0.0 110.746 -176.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.443 HG13 ' HB3' ' A' ' 104' ' ' TYR . 93.4 t -99.01 109.55 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 176.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -70.31 132.5 45.78 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.59 -8.69 58.48 Favored Glycine 0 C--N 1.358 1.787 0 N-CA-C 109.514 -1.434 . . . . 0.0 109.514 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -135.14 -107.12 0.9 Allowed Glycine 0 C--N 1.355 1.628 0 N-CA-C 108.668 -1.773 . . . . 0.0 108.668 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.5 157.98 24.69 Favored Pre-proline 0 N--CA 1.445 -0.697 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.78 124.95 9.12 Favored 'Trans proline' 0 CA--C 1.514 -0.508 0 C-N-CA 121.156 1.237 . . . . 0.0 112.891 178.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.9 pt -109.34 136.8 44.13 Favored 'Isoleucine or valine' 0 C--N 1.358 0.947 0 CA-C-O 122.055 0.931 . . . . 0.0 108.866 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.8 m -65.62 141.34 58.44 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-O 122.127 0.965 . . . . 0.0 111.918 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -140.74 144.09 35.33 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 106.888 -1.523 . . . . 0.0 106.888 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -130.49 131.89 64.9 Favored 'Isoleucine or valine' 0 C--N 1.356 0.857 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.412 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -138.35 131.96 30.8 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 176.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 66.8 p -129.56 157.88 40.84 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 122.31 1.053 . . . . 0.0 109.431 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -121.74 133.79 54.93 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 95.6 m -155.89 140.75 17.17 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.68 100.86 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.142 0 CA-C-O 122.503 1.145 . . . . 0.0 109.924 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 18.6 p -99.54 164.44 16.61 Favored Pre-proline 0 C--N 1.354 0.786 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -52.41 155.76 9.27 Favored 'Trans proline' 0 C--O 1.206 -1.123 0 C-N-CA 122.249 1.966 . . . . 0.0 115.649 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.26 -53.66 37.25 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.04 -6.64 18.83 Favored 'Trans proline' 0 C--N 1.351 0.707 0 CA-C-N 121.247 1.481 . . . . 0.0 112.704 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.18 24.54 11.09 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.845 -178.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.92 71.0 2.71 Favored 'General case' 0 C--N 1.378 1.838 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -120.74 153.27 37.22 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.965 0.888 . . . . 0.0 109.976 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.4 m -95.38 135.17 37.33 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 178.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -111.11 131.32 55.18 Favored 'General case' 0 C--N 1.361 1.106 0 CA-C-N 121.94 2.154 . . . . 0.0 109.536 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.4 t -125.2 136.94 54.07 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -115.28 125.24 53.05 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.2 mt -126.55 129.18 48.09 Favored 'General case' 0 C--N 1.353 0.758 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -103.04 137.86 40.67 Favored 'General case' 0 C--N 1.356 0.874 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -85.79 110.04 19.08 Favored 'General case' 0 C--N 1.347 0.46 0 O-C-N 121.369 -0.832 . . . . 0.0 109.667 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.0 t30 65.55 26.61 11.67 Favored 'General case' 0 C--N 1.374 1.661 0 C-N-CA 123.707 0.803 . . . . 0.0 109.948 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 65.08 24.1 12.48 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 123.519 0.728 . . . . 0.0 110.873 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -92.28 115.84 28.43 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.36 -26.08 68.25 Favored 'General case' 0 C--N 1.356 0.88 0 N-CA-C 112.462 0.542 . . . . 0.0 112.462 -178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -75.34 -14.62 60.49 Favored 'General case' 0 C--N 1.362 1.135 0 O-C-N 121.307 -0.871 . . . . 0.0 109.713 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.8 mt -116.53 84.26 2.1 Favored 'General case' 0 C--N 1.351 0.637 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.6 m -119.63 129.68 54.71 Favored 'General case' 0 C--N 1.361 1.081 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -109.39 133.17 53.4 Favored 'General case' 0 CA--C 1.492 -1.26 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.58 109.29 15.99 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 103.467 -2.79 . . . . 0.0 103.467 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.6 mm -119.02 117.7 55.15 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 105.302 -2.11 . . . . 0.0 105.302 -176.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.34 140.63 45.22 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 105.421 -2.066 . . . . 0.0 105.421 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.3 mp -154.2 161.57 28.97 Favored Pre-proline 0 C--O 1.242 0.666 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 -179.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -53.27 145.91 42.37 Favored 'Trans proline' 0 CA--C 1.508 -0.813 0 C-N-CA 122.059 1.839 . . . . 0.0 111.788 176.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -60.51 -20.21 59.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.084 -1.01 . . . . 0.0 113.51 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -87.95 -22.82 24.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.682 -179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -95.69 -33.71 12.22 Favored 'General case' 0 C--N 1.361 1.084 0 O-C-N 121.821 -0.549 . . . . 0.0 111.069 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -61.85 -41.22 97.57 Favored 'General case' 0 C--N 1.359 1.015 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -175.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.7 -32.7 73.83 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 120.678 -1.264 . . . . 0.0 111.228 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.36 -41.16 79.58 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 119.688 1.131 . . . . 0.0 109.753 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -66.87 -41.35 87.44 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 121.698 -0.626 . . . . 0.0 109.951 176.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.3 -43.05 98.97 Favored 'General case' 0 C--N 1.357 0.921 0 CA-C-O 120.525 0.202 . . . . 0.0 111.018 -177.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.77 -43.84 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 121.642 -0.661 . . . . 0.0 109.378 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -61.99 -40.65 96.36 Favored 'General case' 0 C--N 1.363 1.193 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.056 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.9 ttp -62.66 -47.92 81.57 Favored 'General case' 0 C--N 1.356 0.855 0 CA-C-O 120.995 0.426 . . . . 0.0 110.794 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.87 -44.73 80.18 Favored 'General case' 0 C--N 1.358 0.949 0 CA-C-O 121.516 0.674 . . . . 0.0 109.709 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -62.17 -48.64 79.16 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.293 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.73 -46.6 93.34 Favored Glycine 0 C--N 1.354 1.562 0 O-C-N 121.243 -0.911 . . . . 0.0 113.753 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.443 ' HB3' HG13 ' A' ' 48' ' ' VAL . 56.4 m-85 -87.46 -39.28 15.35 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 119.54 1.67 . . . . 0.0 113.436 -176.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -82.51 -52.17 7.11 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 120.249 -1.532 . . . . 0.0 112.036 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 72.2 ttt-85 -63.68 -41.75 98.13 Favored 'General case' 0 C--N 1.357 0.927 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -177.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 22.4 mmt -87.53 -22.72 24.69 Favored 'General case' 0 C--N 1.363 1.176 0 O-C-N 121.017 -1.052 . . . . 0.0 110.714 -176.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 61.12 36.63 18.14 Favored 'General case' 0 C--N 1.366 1.31 0 CA-C-O 122.327 1.061 . . . . 0.0 110.854 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -116.16 140.37 49.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.327 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.7 t -89.19 -7.42 55.65 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -86.34 108.86 18.63 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -78.86 151.96 76.94 Favored Pre-proline 0 C--N 1.351 0.661 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.66 139.58 76.15 Favored 'Trans proline' 0 CA--C 1.517 -0.337 0 C-N-CA 121.668 1.579 . . . . 0.0 113.434 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.02 -38.42 96.05 Favored Glycine 0 C--N 1.357 1.727 0 O-C-N 121.903 -0.498 . . . . 0.0 112.388 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.4 -34.07 75.38 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.612 1.206 . . . . 0.0 109.943 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -70.14 -40.03 75.05 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -71.21 -30.41 66.35 Favored 'General case' 0 C--N 1.362 1.15 0 O-C-N 121.946 -0.471 . . . . 0.0 110.332 -178.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -60.72 -49.73 76.33 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.756 0.788 . . . . 0.0 110.05 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -67.16 -41.47 85.94 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.347 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 5.8 mp -70.14 -41.27 74.1 Favored 'General case' 0 C--N 1.357 0.921 0 O-C-N 121.889 -0.507 . . . . 0.0 111.108 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.0 tp -69.71 -40.22 76.39 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 121.713 -0.617 . . . . 0.0 109.91 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 87.54 32.51 13.27 Favored Glycine 0 C--N 1.366 2.223 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 41.3 t80 -102.77 117.69 35.19 Favored 'General case' 0 C--N 1.351 0.662 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -82.02 96.25 7.67 Favored 'General case' 0 C--N 1.348 0.518 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 20.5 t . . . . . 0 C--O 1.269 2.123 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.236 179.499 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.9 tpt . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 121.479 0.657 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -148.85 165.31 31.89 Favored 'General case' 0 C--N 1.36 1.045 0 O-C-N 121.315 -0.866 . . . . 0.0 109.138 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.8 mm -61.47 -36.7 74.86 Favored 'Isoleucine or valine' 0 C--N 1.364 1.204 0 C-N-CA 124.088 0.955 . . . . 0.0 110.705 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -63.52 -15.06 56.87 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -176.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -91.69 -4.43 55.15 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 121.44 -0.787 . . . . 0.0 109.323 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.3 mt -106.37 -107.44 0.31 Allowed 'General case' 0 C--N 1.35 0.59 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.708 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -90.69 158.01 43.14 Favored Pre-proline 0 C--N 1.345 0.401 0 N-CA-C 106.504 -1.665 . . . . 0.0 106.504 179.259 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.708 ' HD2' HG22 ' A' ' 7' ' ' VAL . 75.3 Cg_exo -56.5 128.11 28.7 Favored 'Trans proline' 0 N--CA 1.477 0.537 0 CA-C-N 119.703 0.93 . . . . 0.0 112.416 176.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.14 119.82 24.07 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 123.138 1.447 . . . . 0.0 111.905 -176.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -83.5 162.72 52.54 Favored Pre-proline 0 N--CA 1.443 -0.805 0 CA-C-N 113.484 -1.689 . . . . 0.0 106.716 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -55.86 -26.52 58.07 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 C-N-CA 122.361 2.04 . . . . 0.0 113.401 177.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -72.54 -50.52 25.1 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 124.433 1.093 . . . . 0.0 108.578 178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -46.01 85.37 Favored 'General case' 0 C--N 1.363 1.169 0 C-N-CA 125.612 1.565 . . . . 0.0 110.935 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.6 t -61.04 -43.24 95.76 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 CA-C-N 114.964 -1.017 . . . . 0.0 109.685 179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.9 m -71.91 -36.86 70.11 Favored 'General case' 0 C--N 1.363 1.195 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.187 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 77.7 mt -68.22 -39.1 82.45 Favored 'General case' 0 C--N 1.37 1.461 0 O-C-N 121.325 -0.859 . . . . 0.0 110.199 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.403 ' CD1' HD21 ' A' ' 34' ' ' LEU . 70.3 t80 -74.24 -16.27 60.96 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.817 -0.552 . . . . 0.0 112.184 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.7 m -61.8 -52.03 71.59 Favored Pre-proline 0 N--CA 1.486 1.372 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -60.96 142.6 98.03 Favored 'Trans proline' 0 N--CA 1.487 1.113 0 CA-C-N 121.553 1.59 . . . . 0.0 115.439 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.418 ' CD1' HD22 ' A' ' 30' ' ' LEU . 74.0 t80 -142.57 128.92 20.0 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -120.52 138.2 53.97 Favored 'General case' 0 C--N 1.356 0.884 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.8 t -165.29 155.23 13.13 Favored 'General case' 0 C--N 1.353 0.755 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -91.9 -7.46 49.17 Favored 'General case' 0 C--N 1.358 0.935 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.77 -86.58 0.03 OUTLIER 'General case' 0 C--N 1.356 0.89 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -166.07 166.57 17.09 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 177.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 25.0 ttm180 66.94 52.3 0.91 Allowed 'General case' 0 C--N 1.364 1.218 0 CA-C-O 121.992 0.901 . . . . 0.0 109.346 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -84.37 121.03 26.96 Favored 'General case' 0 C--N 1.36 1.056 0 O-C-N 121.232 -0.917 . . . . 0.0 109.009 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.7 ptt180 -64.66 -16.73 63.24 Favored 'General case' 0 C--N 1.359 1.02 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -69.11 -35.12 76.1 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 121.258 -0.901 . . . . 0.0 111.584 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.418 HD22 ' CD1' ' A' ' 20' ' ' TYR . 62.9 tp -64.1 -57.06 19.7 Favored Pre-proline 0 C--N 1.365 1.24 0 O-C-N 121.463 -0.773 . . . . 0.0 112.399 -178.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.92 -17.26 32.45 Favored 'Trans proline' 0 C--N 1.355 0.921 0 CA-C-N 120.638 1.263 . . . . 0.0 114.957 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -68.32 -37.19 80.33 Favored 'General case' 0 C--N 1.359 1.007 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.44 -18.5 60.63 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 121.957 -0.465 . . . . 0.0 110.039 -177.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.403 HD21 ' CD1' ' A' ' 17' ' ' TYR . 94.5 mt -72.38 -22.32 61.15 Favored 'General case' 0 C--N 1.36 1.051 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 66.0 m -84.77 -25.39 28.25 Favored 'General case' 0 C--N 1.356 0.848 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.591 ' CD2' HD11 ' A' ' 42' ' ' ILE . 6.4 mp -74.92 -41.34 59.88 Favored 'General case' 0 C--N 1.358 0.958 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.97 -29.14 59.78 Favored 'General case' 0 C--N 1.358 0.94 0 CA-C-N 114.25 -1.341 . . . . 0.0 112.638 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -64.01 -13.32 45.83 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 121.285 -0.884 . . . . 0.0 112.79 -177.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 118.64 2.36 14.82 Favored Glycine 0 C--N 1.376 2.777 0 CA-C-N 119.953 1.251 . . . . 0.0 110.854 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 72.6 m -70.4 -42.17 72.04 Favored 'General case' 0 C--N 1.358 0.942 0 CA-C-N 118.531 1.165 . . . . 0.0 109.975 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.8 t 64.83 -175.9 0.17 Allowed 'General case' 0 C--N 1.372 1.572 0 CA-C-O 121.477 0.656 . . . . 0.0 110.943 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.591 HD11 ' CD2' ' A' ' 36' ' ' LEU . 2.8 mp -138.27 125.97 29.03 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -152.35 126.91 9.41 Favored 'General case' 0 N--CA 1.436 -1.132 0 N-CA-C 103.451 -2.796 . . . . 0.0 103.451 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.83 -169.02 40.8 Favored Glycine 0 CA--C 1.494 -1.245 0 N-CA-C 108.667 -1.773 . . . . 0.0 108.667 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 55' ' ' SER . 68.8 m -122.1 117.17 25.65 Favored 'General case' 0 CA--C 1.502 -0.898 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -95.04 130.78 41.58 Favored 'General case' 0 C--N 1.355 0.807 0 N-CA-C 107.424 -1.325 . . . . 0.0 107.424 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.93 118.71 23.17 Favored 'General case' 0 N--CA 1.433 -1.296 0 CA-C-O 122.725 1.25 . . . . 0.0 109.8 -177.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.566 HG13 ' HB3' ' A' ' 104' ' ' TYR . 81.4 t -101.86 115.33 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.236 0 N-CA-C 104.205 -2.517 . . . . 0.0 104.205 177.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -71.13 138.46 49.67 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.628 0.728 . . . . 0.0 109.479 -178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.21 -8.55 62.8 Favored Glycine 0 C--N 1.36 1.874 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.97 -103.53 0.55 Allowed Glycine 0 C--N 1.356 1.642 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.83 159.48 22.32 Favored Pre-proline 0 N--CA 1.447 -0.58 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.18 123.72 7.99 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.382 1.388 . . . . 0.0 112.84 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.4 pt -109.1 137.1 42.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.841 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 45' ' ' SER . 77.3 p -67.78 148.02 51.8 Favored 'General case' 0 C--N 1.364 1.206 0 CA-C-O 122.695 1.236 . . . . 0.0 112.188 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 p90 -145.8 146.52 31.21 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.2 t -129.86 130.76 66.59 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.755 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 178.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.75 135.79 35.06 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 177.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -134.99 154.1 51.85 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 122.406 1.098 . . . . 0.0 109.781 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.26 124.94 35.72 Favored 'General case' 0 C--N 1.354 0.798 0 N-CA-C 105.011 -2.218 . . . . 0.0 105.011 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 51.8 m -152.63 151.48 30.66 Favored 'General case' 0 CA--C 1.492 -1.267 0 N-CA-C 103.311 -2.848 . . . . 0.0 103.311 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -70.57 101.31 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 122.525 1.155 . . . . 0.0 111.177 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 23.1 p -99.25 157.34 34.21 Favored Pre-proline 0 C--N 1.352 0.717 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 176.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -50.46 151.05 10.58 Favored 'Trans proline' 0 CA--C 1.498 -1.293 0 C-N-CA 122.092 1.862 . . . . 0.0 115.586 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 tp -45.74 -52.97 22.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -74.01 -6.66 18.87 Favored 'Trans proline' 0 C--N 1.352 0.746 0 CA-C-N 121.582 1.601 . . . . 0.0 113.127 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.6 25.91 10.08 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 43.8 p-10 -72.67 63.41 0.6 Allowed 'General case' 0 C--N 1.374 1.635 0 CA-C-O 121.822 0.82 . . . . 0.0 111.328 -177.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 58.7 mtt -116.39 153.39 32.13 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 122.107 0.956 . . . . 0.0 110.244 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.8 m -96.72 135.8 38.14 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 104.829 -2.286 . . . . 0.0 104.829 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -113.32 132.51 55.54 Favored 'General case' 0 C--N 1.363 1.156 0 CA-C-N 122.285 2.311 . . . . 0.0 109.914 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 12.3 t -125.73 138.3 53.86 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -115.88 125.05 52.11 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 177.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.5 mt -127.07 128.15 45.82 Favored 'General case' 0 C--N 1.354 0.767 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -104.84 135.78 45.57 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -85.99 114.3 22.77 Favored 'General case' 0 C--N 1.345 0.409 0 O-C-N 121.398 -0.814 . . . . 0.0 109.622 -177.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 63.58 25.52 14.39 Favored 'General case' 0 C--N 1.374 1.655 0 C-N-CA 123.825 0.85 . . . . 0.0 110.552 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 63.71 27.82 14.82 Favored 'General case' 0 C--N 1.372 1.548 0 C-N-CA 123.452 0.701 . . . . 0.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -96.36 114.29 25.95 Favored 'General case' 0 C--N 1.348 0.54 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.03 -25.52 67.71 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -74.0 -16.71 61.05 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.265 -0.897 . . . . 0.0 109.416 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.7 mt -114.55 80.84 1.46 Allowed 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 106.851 -1.536 . . . . 0.0 106.851 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.7 m -118.87 128.56 54.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -177.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -110.0 133.43 53.2 Favored 'General case' 0 CA--C 1.492 -1.254 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -117.45 109.66 17.03 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 103.224 -2.88 . . . . 0.0 103.224 178.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.0 mm -118.82 118.74 58.79 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.165 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.14 141.57 45.98 Favored 'General case' 0 N--CA 1.424 -1.76 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.6 mp -150.67 160.32 32.77 Favored Pre-proline 0 CA--C 1.51 -0.562 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 -178.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -52.78 149.73 24.57 Favored 'Trans proline' 0 N--CA 1.482 0.848 0 C-N-CA 122.116 1.877 . . . . 0.0 111.273 176.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -62.35 -18.49 61.62 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.701 -1.25 . . . . 0.0 113.778 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 53.5 p-80 -88.94 -22.94 22.82 Favored 'General case' 0 C--N 1.35 0.619 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -95.31 -30.13 14.11 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 122.002 -0.436 . . . . 0.0 110.772 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -64.66 -40.17 94.96 Favored 'General case' 0 C--N 1.364 1.196 0 O-C-N 121.919 -0.488 . . . . 0.0 111.62 -176.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.2 tp -64.28 -37.81 88.83 Favored 'General case' 0 C--N 1.36 1.041 0 O-C-N 120.355 -1.466 . . . . 0.0 109.814 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -58.98 -41.18 86.95 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 120.051 1.296 . . . . 0.0 109.487 178.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -61.03 -48.98 79.25 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 123.828 0.851 . . . . 0.0 109.939 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.39 -40.94 88.16 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.021 0.528 . . . . 0.0 112.133 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -61.8 -46.91 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 O-C-N 121.57 -0.706 . . . . 0.0 109.851 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.77 -42.55 99.74 Favored 'General case' 0 C--N 1.359 0.994 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.395 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 64.2 ttp -63.52 -48.32 78.02 Favored 'General case' 0 C--N 1.356 0.873 0 CA-C-O 121.006 0.431 . . . . 0.0 110.859 178.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 54.6 tp -64.75 -49.16 71.88 Favored 'General case' 0 C--N 1.356 0.853 0 CA-C-O 121.367 0.603 . . . . 0.0 110.532 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.3 ttp -61.78 -50.28 72.97 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 122.834 0.453 . . . . 0.0 112.035 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -61.36 -44.69 97.72 Favored Glycine 0 C--N 1.359 1.812 0 CA-C-O 119.048 -0.862 . . . . 0.0 114.748 -174.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.566 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.0 m-85 -84.6 -32.3 23.82 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.707 1.753 . . . . 0.0 112.085 -176.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -83.47 -50.63 8.1 Favored 'General case' 0 C--N 1.35 0.592 0 O-C-N 120.79 -1.194 . . . . 0.0 111.5 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.8 ttt180 -63.37 -42.49 98.87 Favored 'General case' 0 C--N 1.358 0.97 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 38.7 mmt -82.33 -21.33 36.08 Favored 'General case' 0 C--N 1.368 1.407 0 O-C-N 120.757 -1.215 . . . . 0.0 110.395 -177.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.0 mt-30 60.93 39.06 17.15 Favored 'General case' 0 C--N 1.369 1.427 0 CA-C-O 122.472 1.13 . . . . 0.0 110.494 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt -137.32 145.69 43.72 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 114.033 -1.44 . . . . 0.0 107.239 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 3.3 m -95.83 56.34 1.72 Allowed 'General case' 0 C--N 1.358 0.939 0 CA-C-O 122.308 1.051 . . . . 0.0 108.252 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -127.09 132.95 50.52 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -105.55 148.15 35.87 Favored Pre-proline 0 C--N 1.349 0.582 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -65.06 141.56 70.61 Favored 'Trans proline' 0 CA--C 1.518 -0.287 0 C-N-CA 121.255 1.303 . . . . 0.0 112.191 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -39.56 97.42 Favored Glycine 0 C--N 1.357 1.731 0 O-C-N 121.818 -0.551 . . . . 0.0 112.769 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.33 -31.59 68.95 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 118.637 1.218 . . . . 0.0 109.926 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -71.16 -33.26 69.86 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -73.53 -17.46 61.2 Favored 'General case' 0 C--N 1.363 1.19 0 O-C-N 121.596 -0.69 . . . . 0.0 111.005 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -65.96 -43.01 89.18 Favored 'General case' 0 C--N 1.369 1.45 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -64.76 -39.07 93.01 Favored 'General case' 0 C--N 1.353 0.725 0 CA-C-N 113.168 -1.833 . . . . 0.0 110.863 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.2 mp -71.12 -43.84 66.82 Favored 'General case' 0 C--N 1.359 0.983 0 O-C-N 121.839 -0.538 . . . . 0.0 110.202 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.5 tp -68.25 -40.62 81.88 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 122.696 0.398 . . . . 0.0 110.551 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 100.32 36.42 4.12 Favored Glycine 0 C--N 1.36 1.898 0 N-CA-C 107.918 -2.073 . . . . 0.0 107.918 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -103.32 121.85 43.6 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -82.81 95.9 8.05 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.263 1.798 0 CA-C-O 118.334 -0.841 . . . . 0.0 109.924 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.5 ttp . . . . . 0 N--CA 1.502 2.165 0 CA-C-O 121.688 0.756 . . . . 0.0 111.372 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -150.29 160.0 44.04 Favored 'General case' 0 C--N 1.36 1.05 0 O-C-N 121.047 -1.033 . . . . 0.0 109.609 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.0 pt -70.5 -14.15 17.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.478 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -72.49 -10.47 59.82 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 121.082 -1.011 . . . . 0.0 110.168 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -91.03 -4.66 56.19 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.8 mt -107.16 -114.25 0.27 Allowed 'General case' 0 C--N 1.354 0.783 0 CA-C-O 121.851 0.834 . . . . 0.0 108.773 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.721 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -89.98 157.94 45.15 Favored Pre-proline 0 C--N 1.346 0.445 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 -179.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.721 ' HD2' HG22 ' A' ' 7' ' ' VAL . 71.2 Cg_exo -56.04 128.8 31.74 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 120.845 1.03 . . . . 0.0 112.283 176.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.86 118.5 20.95 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-O 123.309 1.528 . . . . 0.0 112.552 -175.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -84.78 161.56 52.91 Favored Pre-proline 0 N--CA 1.443 -0.81 0 CA-C-N 113.252 -1.795 . . . . 0.0 106.328 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.41 -18.18 51.86 Favored 'Trans proline' 0 N--CA 1.489 1.26 0 C-N-CA 122.036 1.824 . . . . 0.0 113.568 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -79.07 -52.86 7.63 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.04 1.336 . . . . 0.0 107.624 178.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.9 -45.93 74.76 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 125.564 1.546 . . . . 0.0 110.987 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 41.6 t -60.45 -41.17 86.56 Favored 'Isoleucine or valine' 0 C--N 1.351 0.66 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.242 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 60.6 m -78.85 -19.26 52.45 Favored 'General case' 0 C--N 1.365 1.252 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.794 -175.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.2 mt -83.92 -43.38 15.32 Favored 'General case' 0 C--N 1.368 1.371 0 CA-C-N 119.283 0.947 . . . . 0.0 108.615 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -65.32 -42.25 93.18 Favored 'General case' 0 C--N 1.352 0.687 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 56.5 m -53.26 -53.15 59.22 Favored Pre-proline 0 N--CA 1.491 1.622 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -83.8 76.02 3.88 Favored 'Trans proline' 0 C--O 1.233 0.252 0 CA-C-N 121.551 1.59 . . . . 0.0 113.859 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HB3' HD13 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -73.05 117.52 14.88 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-O 121.572 0.701 . . . . 0.0 109.6 179.815 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -94.25 126.35 39.45 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.5 m -152.48 136.08 16.09 Favored 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -95.49 70.63 3.1 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -172.11 -176.58 1.68 Allowed 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -97.45 13.18 30.72 Favored 'General case' 0 C--N 1.357 0.912 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.0 tpt180 -141.47 145.3 35.07 Favored 'General case' 0 C--N 1.352 0.708 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -79.84 70.95 6.47 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -77.07 -12.8 59.99 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -100.53 -17.3 17.17 Favored 'General case' 0 C--N 1.363 1.187 0 O-C-N 121.318 -0.864 . . . . 0.0 110.109 -178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.439 HD13 ' HB3' ' A' ' 20' ' ' TYR . 62.4 tp -62.39 -51.61 72.11 Favored Pre-proline 0 C--N 1.358 0.936 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -179.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -64.7 -23.01 63.69 Favored 'Trans proline' 0 C--N 1.354 0.844 0 CA-C-N 121.048 1.41 . . . . 0.0 115.633 -177.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -76.69 -28.7 55.99 Favored 'General case' 0 C--N 1.359 1.014 0 O-C-N 121.359 -0.838 . . . . 0.0 108.838 -179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.78 -18.65 50.5 Favored 'General case' 0 C--N 1.365 1.256 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.43 -16.95 61.3 Favored 'General case' 0 C--N 1.359 0.999 0 O-C-N 121.001 -1.062 . . . . 0.0 108.658 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.9 m -85.09 -17.19 38.12 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.55 ' CD2' HD11 ' A' ' 42' ' ' ILE . 7.7 mp -86.13 -47.67 9.3 Favored 'General case' 0 C--N 1.361 1.097 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -67.3 -11.53 57.81 Favored 'General case' 0 C--N 1.363 1.17 0 CA-C-N 115.186 -0.915 . . . . 0.0 112.051 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -73.11 -12.26 60.84 Favored 'General case' 0 C--N 1.362 1.109 0 O-C-N 120.749 -1.219 . . . . 0.0 109.034 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 117.6 10.23 9.54 Favored Glycine 0 C--N 1.377 2.85 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -71.24 -45.54 63.02 Favored 'General case' 0 C--N 1.355 0.848 0 CA-C-N 118.718 1.259 . . . . 0.0 110.935 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.5 t 66.56 177.17 0.23 Allowed 'General case' 0 C--N 1.374 1.636 0 CA-C-O 121.19 0.519 . . . . 0.0 109.795 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.55 HD11 ' CD2' ' A' ' 36' ' ' LEU . 1.6 mp -140.53 129.03 25.04 Favored 'Isoleucine or valine' 0 C--N 1.364 1.231 0 O-C-N 120.642 -1.287 . . . . 0.0 108.931 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -154.65 125.76 7.24 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 103.219 -2.882 . . . . 0.0 103.219 177.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 177.3 -168.74 40.65 Favored Glycine 0 C--N 1.35 1.316 0 N-CA-C 108.545 -1.822 . . . . 0.0 108.545 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 p -121.15 114.92 22.13 Favored 'General case' 0 CA--C 1.509 -0.597 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -93.95 131.2 39.64 Favored 'General case' 0 C--N 1.355 0.83 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -81.95 126.37 31.86 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.762 1.268 . . . . 0.0 109.522 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.501 HG13 ' HB3' ' A' ' 104' ' ' TYR . 93.4 t -110.46 116.85 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.256 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.0 mp0 -73.31 135.54 44.41 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 94.83 9.42 58.54 Favored Glycine 0 C--N 1.359 1.837 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -156.96 -107.89 0.26 Allowed Glycine 0 CA--C 1.492 -1.386 0 N-CA-C 109.045 -1.622 . . . . 0.0 109.045 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -162.4 159.19 20.59 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.93 122.55 7.31 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.32 1.347 . . . . 0.0 112.622 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.0 pt -109.97 137.27 42.99 Favored 'Isoleucine or valine' 0 C--N 1.355 0.842 0 CA-C-O 122.152 0.977 . . . . 0.0 108.776 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.9 m -65.19 140.76 58.79 Favored 'General case' 0 C--N 1.365 1.271 0 CA-C-O 122.143 0.973 . . . . 0.0 111.541 178.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.05 143.5 36.4 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.6 t -129.34 132.6 66.58 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.757 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.532 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -136.32 128.65 30.11 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 177.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 p -127.97 164.58 22.01 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.874 0.845 . . . . 0.0 108.779 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 65.1 p-90 -137.22 153.94 50.28 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.558 HG23 HG23 ' A' ' 63' ' ' THR . 15.3 t -164.41 148.04 9.32 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 103.189 -2.893 . . . . 0.0 103.189 176.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -76.62 99.5 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 122.593 1.187 . . . . 0.0 108.994 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.558 HG23 HG23 ' A' ' 61' ' ' THR . 1.1 p -99.84 160.49 27.15 Favored Pre-proline 0 C--N 1.356 0.853 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 178.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -51.79 153.46 11.41 Favored 'Trans proline' 0 CA--C 1.501 -1.128 0 C-N-CA 122.175 1.917 . . . . 0.0 115.401 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.0 tp -41.09 -54.78 5.43 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.45 -8.48 22.69 Favored 'Trans proline' 0 C--N 1.353 0.789 0 CA-C-N 121.494 1.569 . . . . 0.0 113.303 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.41 24.0 11.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.03 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -76.76 73.85 3.41 Favored 'General case' 0 C--N 1.375 1.704 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.4 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 58.7 mtt -123.98 153.86 40.65 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.043 0.925 . . . . 0.0 110.886 -176.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 46.7 m -92.84 137.84 32.01 Favored 'General case' 0 C--N 1.359 0.989 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -115.13 129.68 56.73 Favored 'General case' 0 C--N 1.364 1.21 0 CA-C-N 122.006 2.184 . . . . 0.0 109.456 -178.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 8.9 t -125.33 140.62 52.66 Favored 'General case' 0 C--N 1.353 0.757 0 CA-C-O 122.048 0.928 . . . . 0.0 108.714 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -118.85 124.24 46.67 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.612 -1.995 . . . . 0.0 105.612 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 mt -126.45 127.43 45.39 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -100.77 138.91 37.19 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 179.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -85.93 112.14 20.9 Favored 'General case' 0 C--N 1.347 0.47 0 O-C-N 121.395 -0.815 . . . . 0.0 109.113 -177.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.9 25.85 15.27 Favored 'General case' 0 C--N 1.374 1.641 0 C-N-CA 123.755 0.822 . . . . 0.0 110.58 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 66.44 22.48 10.71 Favored 'General case' 0 C--N 1.371 1.533 0 C-N-CA 123.555 0.742 . . . . 0.0 110.864 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -91.87 115.6 28.2 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.43 -24.98 67.72 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -75.55 -14.34 60.4 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 121.331 -0.856 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 82.0 mt -117.08 87.06 2.62 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -122.07 131.67 54.1 Favored 'General case' 0 C--N 1.359 1.022 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 -177.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -108.54 130.56 55.28 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -118.54 107.88 14.3 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 103.082 -2.932 . . . . 0.0 103.082 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 51.3 mm -122.91 120.18 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.0 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 -175.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.81 140.12 45.62 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 105.41 -2.07 . . . . 0.0 105.41 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.4 mp -152.33 161.08 30.31 Favored Pre-proline 0 C--O 1.238 0.486 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.4 ' HA ' ' HA ' ' A' ' 69' ' ' MET . 82.7 Cg_exo -52.82 147.87 30.72 Favored 'Trans proline' 0 N--CA 1.486 1.061 0 C-N-CA 122.2 1.933 . . . . 0.0 112.571 177.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -19.27 58.11 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.926 -1.109 . . . . 0.0 112.893 -175.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.7 p-80 -89.43 -24.54 21.86 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 121.573 -0.704 . . . . 0.0 109.587 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -94.19 -34.42 12.92 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 121.14 0.495 . . . . 0.0 111.021 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.16 -39.32 92.26 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 123.254 0.622 . . . . 0.0 112.542 -176.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.36 -31.96 73.37 Favored 'General case' 0 C--O 1.203 -1.366 0 O-C-N 120.509 -1.37 . . . . 0.0 110.333 -177.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -58.34 -42.01 85.9 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 119.862 1.21 . . . . 0.0 109.425 178.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -61.96 -47.7 83.69 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 123.093 0.557 . . . . 0.0 109.543 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -43.55 98.38 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.712 -176.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -46.03 97.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 O-C-N 121.431 -0.793 . . . . 0.0 109.485 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -60.75 -42.64 97.79 Favored 'General case' 0 C--N 1.361 1.097 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.02 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.2 ttp -62.32 -50.14 72.83 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 123.166 0.586 . . . . 0.0 111.27 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -65.67 -48.02 73.5 Favored 'General case' 0 C--N 1.359 0.997 0 CA-C-O 121.397 0.618 . . . . 0.0 111.006 -178.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 36.3 mmt -63.79 -51.87 62.84 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -63.69 -44.87 95.75 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 115.062 0.785 . . . . 0.0 115.062 -174.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.501 ' HB3' HG13 ' A' ' 48' ' ' VAL . 49.3 m-85 -75.78 -36.84 59.67 Favored 'General case' 0 C--N 1.359 1.014 0 CA-C-N 119.37 1.585 . . . . 0.0 110.738 -176.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -73.78 -45.15 53.45 Favored 'General case' 0 C--N 1.352 0.707 0 O-C-N 121.793 -0.567 . . . . 0.0 110.845 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -65.35 -46.28 80.82 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 113.764 1.024 . . . . 0.0 113.764 -177.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.8 mtm -85.4 -22.34 28.42 Favored 'General case' 0 C--N 1.367 1.347 0 O-C-N 120.811 -1.181 . . . . 0.0 111.194 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 60.11 38.64 20.31 Favored 'General case' 0 C--N 1.368 1.405 0 CA-C-O 122.338 1.066 . . . . 0.0 110.752 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -137.18 139.52 41.17 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.2 m -94.45 56.31 2.1 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -137.41 108.36 6.71 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.65 154.8 39.81 Favored Pre-proline 0 C--N 1.354 0.764 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -59.96 146.61 95.5 Favored 'Trans proline' 0 N--CA 1.475 0.413 0 C-N-CA 122.027 1.818 . . . . 0.0 113.696 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -66.33 -16.6 65.13 Favored Glycine 0 C--N 1.361 1.966 0 CA-C-O 119.584 -0.565 . . . . 0.0 112.949 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.2 -33.45 73.35 Favored 'General case' 0 C--N 1.358 0.972 0 CA-C-N 119.125 1.463 . . . . 0.0 109.3 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -72.6 -34.75 67.61 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -72.26 -23.72 61.25 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.947 -0.47 . . . . 0.0 110.306 -178.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -63.78 -50.45 68.97 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-O 122.122 0.963 . . . . 0.0 109.322 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -67.58 -40.31 84.83 Favored 'General case' 0 C--N 1.362 1.109 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.193 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.2 mp -68.19 -40.15 82.29 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 122.473 0.309 . . . . 0.0 110.863 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 58.4 tp -68.86 -40.93 79.05 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 121.608 -0.683 . . . . 0.0 109.755 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 94.68 13.51 53.23 Favored Glycine 0 C--N 1.366 2.204 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -102.37 116.35 32.45 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -79.71 96.27 6.19 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.3 t . . . . . 0 C--O 1.263 1.811 0 CA-C-O 118.405 -0.807 . . . . 0.0 109.449 178.717 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.3 ttm . . . . . 0 N--CA 1.503 2.223 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -151.66 159.14 44.15 Favored 'General case' 0 C--N 1.355 0.836 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.5 pt -70.82 -18.17 20.74 Favored 'Isoleucine or valine' 0 C--N 1.357 0.906 0 CA-C-N 115.899 -0.592 . . . . 0.0 112.29 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -73.62 -12.57 60.79 Favored 'General case' 0 C--N 1.36 1.027 0 O-C-N 121.196 -0.94 . . . . 0.0 111.29 -177.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -95.98 -2.88 46.09 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 90.2 mt -104.27 -114.66 0.23 Allowed 'General case' 0 C--N 1.348 0.528 0 CA-C-O 121.947 0.879 . . . . 0.0 109.136 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.72 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -89.49 158.11 46.24 Favored Pre-proline 0 C--N 1.345 0.405 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.72 ' HD2' HG22 ' A' ' 7' ' ' VAL . 89.1 Cg_exo -54.84 127.81 27.78 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 120.797 0.998 . . . . 0.0 112.421 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.08 118.92 19.34 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-O 123.163 1.459 . . . . 0.0 112.5 -175.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -84.21 160.23 57.75 Favored Pre-proline 0 N--CA 1.442 -0.829 0 CA-C-N 113.384 -1.734 . . . . 0.0 106.421 175.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -61.46 -22.44 74.53 Favored 'Trans proline' 0 N--CA 1.483 0.909 0 C-N-CA 121.727 1.618 . . . . 0.0 112.666 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -73.14 -50.47 22.48 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.514 1.126 . . . . 0.0 108.647 177.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.09 -46.27 85.79 Favored 'General case' 0 C--N 1.363 1.173 0 C-N-CA 125.495 1.518 . . . . 0.0 110.872 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.8 t -60.64 -42.92 93.6 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.95 179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.8 m -71.84 -36.5 70.18 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 119.065 -1.054 . . . . 0.0 110.466 -176.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.6 mt -70.8 -40.28 72.63 Favored 'General case' 0 C--N 1.368 1.402 0 O-C-N 121.62 -0.675 . . . . 0.0 110.533 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -71.65 -24.68 61.9 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.0 m -58.5 -54.19 58.56 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -73.67 148.78 42.35 Favored 'Trans proline' 0 C--N 1.348 0.521 0 CA-C-N 121.435 1.548 . . . . 0.0 114.748 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -157.2 165.12 36.83 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -79.92 109.02 13.95 Favored 'General case' 0 C--N 1.354 0.802 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 67.5 m -86.39 60.72 6.4 Favored 'General case' 0 C--N 1.358 0.97 0 O-C-N 121.537 -0.727 . . . . 0.0 109.543 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -98.45 -19.16 17.85 Favored 'General case' 0 C--N 1.356 0.852 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.31 173.86 15.6 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -63.49 -38.65 91.94 Favored 'General case' 0 C--N 1.364 1.224 0 CA-C-O 120.593 0.235 . . . . 0.0 110.46 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -122.97 137.67 54.89 Favored 'General case' 0 C--N 1.354 0.794 0 N-CA-C 106.327 -1.731 . . . . 0.0 106.327 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -116.31 128.66 55.75 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.4 mmm180 -62.58 -37.21 85.3 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 123.02 0.528 . . . . 0.0 111.681 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -67.0 -26.33 66.74 Favored 'General case' 0 C--N 1.351 0.645 0 O-C-N 121.496 -0.753 . . . . 0.0 112.473 -178.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.91 -61.06 8.76 Favored Pre-proline 0 C--N 1.364 1.231 0 CA-C-N 119.112 0.869 . . . . 0.0 112.738 -177.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -73.26 -18.69 23.22 Favored 'Trans proline' 0 C--N 1.351 0.692 0 CA-C-N 120.473 1.205 . . . . 0.0 115.06 -179.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -72.85 -30.7 64.21 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 121.473 -0.767 . . . . 0.0 109.517 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.05 -18.07 56.26 Favored 'General case' 0 C--N 1.363 1.159 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.8 mt -66.07 -36.58 83.58 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.515 -0.74 . . . . 0.0 109.028 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -63.08 -37.98 89.36 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.919 -0.488 . . . . 0.0 109.865 177.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.644 HD23 HD11 ' A' ' 42' ' ' ILE . 7.1 mp -68.41 -43.91 76.17 Favored 'General case' 0 C--N 1.361 1.091 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -56.27 -35.82 67.87 Favored 'General case' 0 C--N 1.364 1.197 0 C-N-CA 124.505 1.122 . . . . 0.0 112.09 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.87 -27.73 69.0 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.56 -0.713 . . . . 0.0 111.54 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 133.49 12.12 1.63 Allowed Glycine 0 C--N 1.354 1.572 0 C-N-CA 120.0 -1.095 . . . . 0.0 111.246 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.1 m -68.93 -43.45 75.1 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 118.817 1.309 . . . . 0.0 109.669 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 t 65.58 176.03 0.21 Allowed 'General case' 0 C--N 1.374 1.662 0 CA-C-O 121.7 0.762 . . . . 0.0 111.056 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.644 HD11 HD23 ' A' ' 36' ' ' LEU . 2.2 mp -139.05 125.08 23.15 Favored 'Isoleucine or valine' 0 C--N 1.36 1.063 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -151.43 125.59 9.3 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 103.016 -2.957 . . . . 0.0 103.016 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.04 -169.89 41.9 Favored Glycine 0 CA--C 1.491 -1.436 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 -178.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.0 m -121.25 115.28 22.71 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -92.19 130.6 37.87 Favored 'General case' 0 C--N 1.357 0.913 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.99 122.34 27.17 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 122.904 1.335 . . . . 0.0 110.277 -177.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.627 HG13 ' HB3' ' A' ' 104' ' ' TYR . 96.6 t -106.15 115.87 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.275 0 N-CA-C 104.069 -2.567 . . . . 0.0 104.069 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -71.33 139.28 49.82 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 121.631 0.729 . . . . 0.0 109.677 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.91 -8.96 63.63 Favored Glycine 0 C--N 1.361 1.961 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -140.1 -102.85 0.53 Allowed Glycine 0 C--N 1.354 1.581 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -161.65 158.97 22.83 Favored Pre-proline 0 N--CA 1.448 -0.545 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.64 126.25 9.44 Favored 'Trans proline' 0 CA--C 1.513 -0.535 0 C-N-CA 121.427 1.418 . . . . 0.0 112.789 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.6 pt -109.56 136.43 45.49 Favored 'Isoleucine or valine' 0 C--N 1.359 0.997 0 CA-C-O 122.042 0.925 . . . . 0.0 108.793 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 61.1 m -64.66 140.84 58.91 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-O 122.141 0.972 . . . . 0.0 112.041 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -140.58 143.88 35.54 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.1 t -129.88 131.08 66.59 Favored 'Isoleucine or valine' 0 C--N 1.353 0.743 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -137.96 129.29 27.72 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 176.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 83.6 m -128.73 132.29 47.96 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 -178.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.61 127.79 50.98 Favored 'General case' 0 C--N 1.352 0.689 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 178.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.5 m -153.59 148.35 26.42 Favored 'General case' 0 CA--C 1.493 -1.243 0 N-CA-C 103.517 -2.771 . . . . 0.0 103.517 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -69.65 102.91 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.435 -1.216 0 CA-C-O 122.446 1.117 . . . . 0.0 111.019 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 24.1 p -99.03 158.58 32.05 Favored Pre-proline 0 C--N 1.354 0.765 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -49.87 155.59 4.0 Favored 'Trans proline' 0 C--O 1.203 -1.274 0 C-N-CA 122.605 2.204 . . . . 0.0 115.831 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.9 mp -52.58 -51.15 75.99 Favored Pre-proline 0 N--CA 1.474 0.737 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.76 -4.57 15.61 Favored 'Trans proline' 0 CA--C 1.512 -0.577 0 CA-C-N 121.162 1.451 . . . . 0.0 112.15 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.93 26.15 9.87 Favored 'General case' 0 C--N 1.348 0.516 0 CA-C-N 115.05 -0.977 . . . . 0.0 108.383 -178.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.6 p-10 -73.02 61.94 0.6 Allowed 'General case' 0 C--N 1.374 1.633 0 CA-C-O 121.86 0.838 . . . . 0.0 111.184 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.426 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 58.9 mtt -117.44 153.29 33.36 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-O 122.003 0.906 . . . . 0.0 110.02 -177.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.9 m -96.1 135.46 37.86 Favored 'General case' 0 C--N 1.354 0.801 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 -111.5 132.03 54.79 Favored 'General case' 0 C--N 1.36 1.06 0 CA-C-N 122.095 2.225 . . . . 0.0 109.896 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.2 t -125.62 138.72 53.93 Favored 'General case' 0 C--N 1.35 0.616 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 178.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -116.63 125.19 51.43 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.33 130.73 50.02 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -104.48 138.94 40.11 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -85.85 113.29 21.88 Favored 'General case' 0 C--N 1.351 0.635 0 O-C-N 121.232 -0.917 . . . . 0.0 109.477 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.9 t30 63.24 26.64 15.25 Favored 'General case' 0 C--N 1.373 1.596 0 C-N-CA 123.584 0.754 . . . . 0.0 110.018 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 65.68 23.49 11.6 Favored 'General case' 0 C--N 1.372 1.584 0 C-N-CA 123.557 0.743 . . . . 0.0 110.978 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -92.82 115.41 28.08 Favored 'General case' 0 C--N 1.353 0.759 0 N-CA-C 106.564 -1.643 . . . . 0.0 106.564 178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.98 -24.41 67.89 Favored 'General case' 0 C--N 1.357 0.902 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -74.29 -16.48 60.93 Favored 'General case' 0 C--N 1.362 1.112 0 O-C-N 121.342 -0.849 . . . . 0.0 109.29 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.0 mt -115.48 87.21 2.62 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.5 m -120.7 130.5 54.11 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -177.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -109.23 132.69 53.89 Favored 'General case' 0 CA--C 1.494 -1.19 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -119.01 108.5 14.82 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 103.23 -2.878 . . . . 0.0 103.23 177.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.7 mm -120.36 119.51 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.075 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.92 141.86 46.4 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.48 160.66 31.45 Favored Pre-proline 0 C--O 1.238 0.467 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 69' ' ' MET . 80.1 Cg_exo -53.83 151.2 26.99 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 122.246 1.964 . . . . 0.0 111.889 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.88 -18.02 53.82 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.639 -1.288 . . . . 0.0 113.312 -175.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -89.62 -28.45 19.5 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.359 -0.838 . . . . 0.0 108.89 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -92.26 -28.66 16.85 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 121.7 -0.625 . . . . 0.0 111.015 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -64.32 -38.75 92.15 Favored 'General case' 0 C--N 1.36 1.055 0 O-C-N 121.676 -0.64 . . . . 0.0 111.591 -177.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.405 ' O ' HG13 ' A' ' 98' ' ' ILE . 8.6 mp -66.45 -32.89 74.54 Favored 'General case' 0 C--O 1.202 -1.426 0 O-C-N 120.488 -1.382 . . . . 0.0 109.66 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -58.58 -42.52 88.2 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 119.864 1.211 . . . . 0.0 109.024 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -62.65 -48.75 77.98 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.936 0.894 . . . . 0.0 110.243 175.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -43.08 99.44 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -176.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -63.54 -41.03 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 O-C-N 121.343 -0.848 . . . . 0.0 109.756 179.935 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.96 -39.6 92.69 Favored 'General case' 0 C--N 1.362 1.145 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.925 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.2 mtp -63.44 -49.06 75.19 Favored 'General case' 0 C--N 1.362 1.146 0 CA-C-O 121.112 0.482 . . . . 0.0 110.945 178.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.3 -46.16 81.5 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-O 121.329 0.585 . . . . 0.0 110.087 -177.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 28.2 ttt -64.03 -50.44 68.46 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.636 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.91 -44.98 93.82 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.145 -0.808 . . . . 0.0 115.056 -175.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.627 ' HB3' HG13 ' A' ' 48' ' ' VAL . 57.6 m-85 -85.06 -33.53 22.45 Favored 'General case' 0 C--N 1.359 1.0 0 CA-C-N 119.753 1.776 . . . . 0.0 112.226 -175.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -81.7 -49.81 10.02 Favored 'General case' 0 C--N 1.349 0.562 0 O-C-N 120.878 -1.139 . . . . 0.0 111.59 -176.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -63.56 -44.78 93.15 Favored 'General case' 0 C--N 1.362 1.119 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 78.1 mtm -86.89 -21.28 26.43 Favored 'General case' 0 C--N 1.365 1.28 0 O-C-N 120.841 -1.162 . . . . 0.0 110.55 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 64.28 34.95 10.28 Favored 'General case' 0 C--N 1.366 1.323 0 CA-C-O 122.488 1.137 . . . . 0.0 110.452 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -117.74 139.64 50.77 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.216 -1.357 . . . . 0.0 107.403 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 14.0 m -87.35 -16.81 33.94 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -75.71 124.38 27.16 Favored 'General case' 0 C--N 1.35 0.617 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -92.87 156.28 40.79 Favored Pre-proline 0 C--N 1.348 0.532 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 -179.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.9 142.26 87.65 Favored 'Trans proline' 0 CA--C 1.519 -0.266 0 C-N-CA 121.632 1.554 . . . . 0.0 113.048 177.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.37 -38.16 95.27 Favored Glycine 0 C--N 1.358 1.754 0 O-C-N 121.844 -0.535 . . . . 0.0 112.535 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.66 72.56 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.659 1.23 . . . . 0.0 109.848 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -70.42 -33.29 71.17 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.58 -19.24 62.17 Favored 'General case' 0 C--N 1.363 1.184 0 O-C-N 121.702 -0.624 . . . . 0.0 110.98 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -64.78 -43.23 93.91 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-O 122.667 1.222 . . . . 0.0 107.995 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -65.0 -40.01 94.32 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 113.378 -1.737 . . . . 0.0 111.217 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 1.8 mp -71.61 -41.79 68.46 Favored 'General case' 0 C--N 1.358 0.944 0 O-C-N 121.848 -0.533 . . . . 0.0 110.462 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.4 tp -68.3 -40.51 81.73 Favored 'General case' 0 C--N 1.354 0.797 0 C-N-CA 122.707 0.403 . . . . 0.0 110.491 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 101.73 34.91 4.21 Favored Glycine 0 C--N 1.36 1.884 0 N-CA-C 108.022 -2.031 . . . . 0.0 108.022 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -103.09 121.39 42.52 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -84.16 96.08 8.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.266 1.927 0 CA-C-O 118.164 -0.922 . . . . 0.0 109.881 -179.936 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.5 ttp . . . . . 0 N--CA 1.509 2.496 0 N-CA-C 112.74 0.644 . . . . 0.0 112.74 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -87.23 123.67 32.49 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.5 pt -67.67 -22.02 27.97 Favored 'Isoleucine or valine' 0 C--N 1.366 1.292 0 O-C-N 121.735 -0.603 . . . . 0.0 112.349 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -72.43 -13.38 61.43 Favored 'General case' 0 C--N 1.362 1.125 0 O-C-N 121.271 -0.893 . . . . 0.0 110.978 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -93.72 -5.62 48.03 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.9 mt -104.7 -105.37 0.3 Allowed 'General case' 0 C--N 1.352 0.694 0 CA-C-O 122.024 0.916 . . . . 0.0 109.06 -179.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 5.5 p -89.8 151.48 45.56 Favored Pre-proline 0 C--O 1.236 0.346 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -58.34 125.65 19.07 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-N 119.792 0.962 . . . . 0.0 111.433 175.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.37 119.42 24.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-O 123.143 1.449 . . . . 0.0 112.106 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -83.88 161.8 54.47 Favored Pre-proline 0 N--CA 1.442 -0.837 0 CA-C-N 113.507 -1.679 . . . . 0.0 106.559 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -56.69 -24.72 56.3 Favored 'Trans proline' 0 N--CA 1.488 1.158 0 C-N-CA 122.381 2.054 . . . . 0.0 113.664 177.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -75.29 -52.23 11.35 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.65 -47.55 73.38 Favored 'General case' 0 C--N 1.368 1.377 0 C-N-CA 125.226 1.41 . . . . 0.0 110.767 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.05 -43.78 96.9 Favored 'Isoleucine or valine' 0 C--O 1.245 0.825 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.355 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.1 m -73.19 -36.74 66.61 Favored 'General case' 0 C--N 1.366 1.296 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.756 -175.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 61.5 mt -71.45 -40.95 70.01 Favored 'General case' 0 C--N 1.365 1.276 0 O-C-N 121.649 -0.657 . . . . 0.0 110.389 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.579 ' CE1' HD11 ' A' ' 30' ' ' LEU . 70.6 t80 -63.79 -39.02 93.25 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -179.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.8 m -57.48 -55.22 46.79 Favored Pre-proline 0 CA--C 1.559 1.326 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 -175.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -86.48 77.54 2.26 Favored 'Trans proline' 0 C--N 1.348 0.5 0 CA-C-N 121.597 1.606 . . . . 0.0 115.635 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -124.11 151.27 44.1 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -170.16 -174.37 1.72 Allowed 'General case' 0 C--N 1.354 0.763 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.4 t -153.3 156.94 39.34 Favored 'General case' 0 C--N 1.352 0.681 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -83.62 69.58 10.15 Favored 'General case' 0 C--N 1.357 0.92 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -158.77 -78.29 0.07 Allowed 'General case' 0 C--N 1.352 0.692 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.84 -54.33 0.02 OUTLIER 'General case' 0 C--N 1.358 0.97 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.2 mtp180 -90.89 162.03 14.96 Favored 'General case' 0 C--N 1.358 0.96 0 CA-C-O 121.635 0.731 . . . . 0.0 109.078 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -83.14 75.63 9.91 Favored 'General case' 0 C--N 1.361 1.093 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mmt180 -63.45 -40.58 97.52 Favored 'General case' 0 C--N 1.354 0.794 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -73.96 -21.37 60.04 Favored 'General case' 0 C--N 1.355 0.835 0 O-C-N 121.243 -0.91 . . . . 0.0 112.663 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.579 HD11 ' CE1' ' A' ' 17' ' ' TYR . 56.3 tp -60.53 -57.01 29.64 Favored Pre-proline 0 C--N 1.358 0.974 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -176.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -70.03 -23.08 29.96 Favored 'Trans proline' 0 CA--C 1.509 -0.729 0 CA-C-N 121.233 1.476 . . . . 0.0 114.67 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -71.25 -36.38 71.76 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.21 -17.89 60.26 Favored 'General case' 0 C--N 1.358 0.974 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.456 -177.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.0 mt -69.4 -19.36 63.81 Favored 'General case' 0 C--N 1.362 1.115 0 O-C-N 121.02 -1.05 . . . . 0.0 109.902 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.4 m -84.6 -17.64 38.08 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.683 HD23 HD11 ' A' ' 42' ' ' ILE . 7.5 mp -88.03 -46.12 9.61 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -57.07 -23.9 50.02 Favored 'General case' 0 C--N 1.368 1.412 0 C-N-CA 124.416 1.086 . . . . 0.0 112.993 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -68.47 -10.52 55.96 Favored 'General case' 0 C--N 1.358 0.955 0 O-C-N 121.275 -0.891 . . . . 0.0 111.632 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.25 11.11 11.04 Favored Glycine 0 C--N 1.375 2.714 0 N-CA-C 110.429 -1.068 . . . . 0.0 110.429 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 56.7 m -70.49 -43.55 69.5 Favored 'General case' 0 C--N 1.359 1.021 0 CA-C-N 118.162 0.981 . . . . 0.0 109.69 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.5 t 68.91 175.79 0.28 Allowed 'General case' 0 C--N 1.375 1.716 0 CA-C-O 121.506 0.669 . . . . 0.0 110.465 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.683 HD11 HD23 ' A' ' 36' ' ' LEU . 2.9 mp -137.39 126.25 34.56 Favored 'Isoleucine or valine' 0 C--N 1.361 1.079 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -150.51 126.62 10.56 Favored 'General case' 0 N--CA 1.438 -1.048 0 N-CA-C 103.242 -2.873 . . . . 0.0 103.242 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.71 -169.87 41.55 Favored Glycine 0 CA--C 1.491 -1.437 0 N-CA-C 108.387 -1.885 . . . . 0.0 108.387 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.0 p -122.16 115.4 22.35 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 23.3 tpt180 -92.36 129.59 38.26 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 107.489 -1.3 . . . . 0.0 107.489 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.53 128.13 33.24 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-O 123.017 1.389 . . . . 0.0 110.713 -177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.528 HG13 ' HB3' ' A' ' 104' ' ' TYR . 83.6 t -110.23 116.21 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 N-CA-C 104.122 -2.547 . . . . 0.0 104.122 177.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -73.47 134.31 43.88 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 -178.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.65 58.29 Favored Glycine 0 C--N 1.363 2.03 0 N-CA-C 110.106 -1.198 . . . . 0.0 110.106 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -139.94 -105.28 0.62 Allowed Glycine 0 C--N 1.353 1.523 0 N-CA-C 109.303 -1.519 . . . . 0.0 109.303 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.9 158.27 24.07 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.98 126.06 9.09 Favored 'Trans proline' 0 CA--C 1.513 -0.552 0 C-N-CA 121.439 1.426 . . . . 0.0 112.708 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.1 pt -108.2 135.86 45.6 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 CA-C-O 122.173 0.987 . . . . 0.0 108.703 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.2 m -64.85 141.21 58.85 Favored 'General case' 0 C--N 1.364 1.231 0 CA-C-O 122.189 0.995 . . . . 0.0 111.683 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.5 p90 -141.1 144.76 35.08 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.8 t -129.36 130.16 67.45 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.731 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.53 134.55 34.03 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 177.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.6 t -131.61 149.47 52.49 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-O 122.582 1.182 . . . . 0.0 109.449 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.5 116.62 19.97 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -178.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 63.8 p -140.74 161.56 37.49 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.2 m -79.66 100.67 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.355 0 CA-C-O 122.397 1.094 . . . . 0.0 109.327 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -99.69 161.44 24.42 Favored Pre-proline 0 C--N 1.355 0.826 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -53.31 155.17 12.9 Favored 'Trans proline' 0 C--O 1.208 -1.009 0 C-N-CA 122.129 1.886 . . . . 0.0 115.566 179.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 41.5 tp -49.29 -50.65 63.21 Favored Pre-proline 0 CA--C 1.546 0.798 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -177.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -73.33 -8.49 21.95 Favored 'Trans proline' 0 C--N 1.352 0.759 0 CA-C-N 121.204 1.466 . . . . 0.0 112.394 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.38 25.01 10.75 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.096 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -75.33 65.97 1.71 Allowed 'General case' 0 C--N 1.38 1.898 0 CA-C-O 122.224 1.011 . . . . 0.0 109.066 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 72.3 mtm -120.99 153.38 37.4 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 121.86 0.838 . . . . 0.0 109.525 -177.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 60.4 m -94.44 137.24 33.82 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 -115.85 129.77 56.56 Favored 'General case' 0 C--N 1.362 1.124 0 CA-C-N 122.105 2.23 . . . . 0.0 109.208 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 10.6 t -125.53 139.12 53.88 Favored 'General case' 0 C--N 1.352 0.677 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -119.71 125.59 49.03 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 178.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 mt -126.64 135.18 50.85 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -103.62 139.95 38.23 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.32 106.97 17.76 Favored 'General case' 0 C--N 1.344 0.358 0 O-C-N 121.259 -0.9 . . . . 0.0 109.426 -178.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 40.2 t30 65.52 27.35 11.66 Favored 'General case' 0 C--N 1.374 1.656 0 C-N-CA 123.654 0.782 . . . . 0.0 109.967 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 65.55 23.79 11.78 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 123.637 0.775 . . . . 0.0 110.887 179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -91.73 117.66 29.96 Favored 'General case' 0 C--N 1.351 0.64 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.24 -19.52 66.01 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -86.21 -4.88 59.26 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 121.353 -0.842 . . . . 0.0 109.727 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 74.4 mt -125.82 94.54 4.15 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 -178.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 81.9 p -126.07 149.63 48.75 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.067 0.936 . . . . 0.0 109.321 -176.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -127.18 132.93 50.39 Favored 'General case' 0 CA--C 1.489 -1.39 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 178.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -121.02 110.4 16.22 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 104.028 -2.582 . . . . 0.0 104.028 178.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.3 mm -120.63 116.85 51.31 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.961 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 -177.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.39 139.69 44.39 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -154.98 162.67 26.69 Favored Pre-proline 0 C--O 1.238 0.464 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 -178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -53.25 147.81 34.47 Favored 'Trans proline' 0 N--CA 1.483 0.871 0 C-N-CA 122.372 2.048 . . . . 0.0 112.0 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -18.76 52.05 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 -174.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 17.0 t-160 -89.13 -27.61 20.61 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.441 -0.787 . . . . 0.0 108.955 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -92.69 -31.65 15.03 Favored 'General case' 0 C--N 1.356 0.885 0 O-C-N 121.769 -0.582 . . . . 0.0 111.201 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -63.71 -39.83 95.28 Favored 'General case' 0 C--N 1.36 1.027 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.0 mp -63.59 -28.3 69.84 Favored 'General case' 0 C--N 1.365 1.249 0 O-C-N 120.492 -1.38 . . . . 0.0 110.954 -177.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -59.12 -40.99 87.13 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.388 0.994 . . . . 0.0 109.249 177.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -67.83 -42.98 80.64 Favored 'General case' 0 C--N 1.351 0.655 0 C-N-CA 123.029 0.532 . . . . 0.0 109.831 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -43.5 98.69 Favored 'General case' 0 C--N 1.36 1.047 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -175.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.63 -42.28 95.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 O-C-N 121.493 -0.754 . . . . 0.0 109.368 178.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -63.01 -39.7 95.55 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.276 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 63.4 mtt -63.26 -44.82 94.06 Favored 'General case' 0 C--N 1.364 1.202 0 O-C-N 121.76 -0.587 . . . . 0.0 110.831 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 81.4 mt -69.19 -44.52 71.99 Favored 'General case' 0 C--N 1.354 0.771 0 CA-C-O 121.412 0.625 . . . . 0.0 109.551 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.0 ttp -62.55 -48.91 77.4 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.387 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.84 -47.22 90.67 Favored Glycine 0 C--N 1.353 1.524 0 O-C-N 121.14 -0.975 . . . . 0.0 113.913 -176.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.528 ' HB3' HG13 ' A' ' 48' ' ' VAL . 62.0 m-85 -87.85 -38.93 15.25 Favored 'General case' 0 C--N 1.358 0.973 0 CA-C-N 119.557 1.679 . . . . 0.0 113.622 -175.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -83.59 -51.64 7.13 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 120.302 -1.499 . . . . 0.0 111.794 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -64.6 -41.67 96.07 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 23.7 mmt -84.52 -21.16 30.65 Favored 'General case' 0 C--N 1.365 1.271 0 O-C-N 120.967 -1.083 . . . . 0.0 110.423 -176.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 60.37 43.47 13.39 Favored 'General case' 0 C--N 1.369 1.436 0 CA-C-O 122.395 1.093 . . . . 0.0 110.753 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt -134.96 144.8 47.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.251 -1.34 . . . . 0.0 107.922 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.68 -9.69 48.56 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -80.62 120.6 24.77 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -92.34 151.24 41.3 Favored Pre-proline 0 C--N 1.349 0.554 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_exo -63.82 141.95 80.53 Favored 'Trans proline' 0 CA--C 1.517 -0.344 0 C-N-CA 121.721 1.614 . . . . 0.0 113.398 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.26 -37.64 94.9 Favored Glycine 0 C--N 1.357 1.743 0 O-C-N 121.862 -0.524 . . . . 0.0 112.449 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.47 -29.75 66.39 Favored 'General case' 0 C--N 1.36 1.04 0 CA-C-N 118.535 1.168 . . . . 0.0 109.887 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -36.45 64.96 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -69.71 -26.1 64.18 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.022 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.39 -48.54 80.76 Favored 'General case' 0 C--N 1.356 0.858 0 CA-C-O 122.133 0.968 . . . . 0.0 109.39 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -67.36 -42.18 83.9 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.287 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.5 -40.98 80.68 Favored 'General case' 0 C--N 1.36 1.038 0 O-C-N 121.91 -0.494 . . . . 0.0 111.065 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 60.4 tp -67.08 -40.42 87.01 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 95.69 41.02 3.98 Favored Glycine 0 C--N 1.361 1.933 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -100.53 115.51 30.3 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -86.9 95.88 10.04 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 12.0 t . . . . . 0 C--O 1.264 1.859 0 CA-C-O 118.363 -0.827 . . . . 0.0 109.643 179.084 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 N--CA 1.504 2.234 0 CA-C-O 121.459 0.647 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -141.93 161.87 36.9 Favored 'General case' 0 C--N 1.361 1.074 0 O-C-N 121.334 -0.854 . . . . 0.0 108.969 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.3 pt -64.37 -21.29 28.75 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 123.546 0.738 . . . . 0.0 112.719 -178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -76.08 -8.6 57.37 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 121.131 -0.981 . . . . 0.0 111.165 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.39 -4.0 49.22 Favored 'General case' 0 C--N 1.357 0.915 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 85.6 mt -105.96 -112.93 0.26 Allowed 'General case' 0 C--N 1.349 0.553 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.707 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -90.01 158.3 44.57 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.707 ' HD2' HG22 ' A' ' 7' ' ' VAL . 82.3 Cg_exo -54.92 128.87 32.36 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 120.813 1.009 . . . . 0.0 112.288 176.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.93 117.59 16.94 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 123.161 1.457 . . . . 0.0 112.245 -175.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -85.68 161.45 50.71 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 113.409 -1.723 . . . . 0.0 106.986 176.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.7 -24.57 63.77 Favored 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.49 2.127 . . . . 0.0 113.432 177.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 10.4 mmt85 -74.07 -52.76 11.65 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.581 1.153 . . . . 0.0 107.961 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.61 -46.23 81.02 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.287 1.435 . . . . 0.0 110.764 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.6 t -61.0 -42.71 94.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.578 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -71.26 -36.01 71.59 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.303 -176.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.7 mt -69.78 -40.82 75.82 Favored 'General case' 0 C--N 1.369 1.433 0 O-C-N 121.467 -0.77 . . . . 0.0 110.24 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -75.33 -19.4 59.64 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 121.914 -0.491 . . . . 0.0 112.127 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.4 m -60.55 -54.99 49.38 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -177.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -76.08 151.94 35.32 Favored 'Trans proline' 0 CA--C 1.512 -0.59 0 CA-C-N 121.576 1.599 . . . . 0.0 114.224 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.404 ' CD2' HD22 ' A' ' 30' ' ' LEU . 11.1 m-85 -125.85 148.4 49.17 Favored 'General case' 0 C--N 1.353 0.748 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -87.39 62.93 7.45 Favored 'General case' 0 C--N 1.356 0.877 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 32.3 t -162.46 154.92 19.24 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -69.0 -37.15 78.55 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -150.3 152.34 34.33 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 75.01 175.74 0.24 Allowed 'General case' 0 C--N 1.37 1.464 0 CA-C-O 122.004 0.907 . . . . 0.0 110.106 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 76.5 mtm180 -88.1 146.74 25.28 Favored 'General case' 0 C--N 1.354 0.781 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.449 ' HG3' ' H ' ' A' ' 29' ' ' TYR . 31.7 tpt180 -95.65 145.63 25.11 Favored 'General case' 0 C--N 1.355 0.826 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -58.92 -23.16 60.94 Favored 'General case' 0 C--N 1.36 1.042 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.449 ' H ' ' HG3' ' A' ' 27' ' ' ARG . 24.8 m-85 -78.77 -13.79 59.62 Favored 'General case' 0 C--N 1.359 1.001 0 O-C-N 120.672 -1.267 . . . . 0.0 110.812 179.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.404 HD22 ' CD2' ' A' ' 20' ' ' TYR . 55.4 tp -66.39 -55.03 21.2 Favored Pre-proline 0 C--N 1.367 1.351 0 O-C-N 121.283 -0.885 . . . . 0.0 112.345 -178.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -64.95 -20.25 64.14 Favored 'Trans proline' 0 C--N 1.358 1.07 0 CA-C-N 120.804 1.323 . . . . 0.0 114.713 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -73.19 -29.47 62.85 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.43 -17.93 57.67 Favored 'General case' 0 C--N 1.365 1.259 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.29 -36.09 80.82 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.3 t -63.69 -38.08 89.76 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.601 HD23 HD11 ' A' ' 42' ' ' ILE . 7.1 mp -68.67 -45.23 72.26 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 178.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -57.93 -37.71 74.6 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 124.65 1.18 . . . . 0.0 112.583 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -64.69 -10.23 25.59 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 121.305 -0.872 . . . . 0.0 112.529 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 125.39 2.49 7.56 Favored Glycine 0 C--N 1.374 2.663 0 CA-C-N 119.466 1.03 . . . . 0.0 111.889 177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.0 t -68.24 -46.0 71.7 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-N 119.259 1.529 . . . . 0.0 109.828 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 63.31 -178.34 0.15 Allowed 'General case' 0 C--N 1.371 1.517 0 CA-C-O 121.301 0.572 . . . . 0.0 110.75 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.601 HD11 HD23 ' A' ' 36' ' ' LEU . 1.7 mp -140.6 125.92 19.6 Favored 'Isoleucine or valine' 0 C--N 1.363 1.191 0 CA-C-O 122.511 1.148 . . . . 0.0 108.453 179.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -154.03 125.71 7.63 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 103.014 -2.958 . . . . 0.0 103.014 177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.41 -170.24 42.21 Favored Glycine 0 CA--C 1.492 -1.374 0 N-CA-C 108.456 -1.858 . . . . 0.0 108.456 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -119.13 112.66 19.8 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.316 -1.735 . . . . 0.0 106.316 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.3 tpt180 -95.66 132.49 40.79 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -76.04 129.8 37.4 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.959 1.362 . . . . 0.0 110.32 -178.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 66.1 t -114.0 119.34 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.076 0 N-CA-C 104.177 -2.527 . . . . 0.0 104.177 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -72.61 135.95 45.62 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 121.419 0.628 . . . . 0.0 109.333 -178.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.41 -5.3 57.19 Favored Glycine 0 C--N 1.36 1.879 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -145.77 -103.5 0.38 Allowed Glycine 0 C--N 1.355 1.616 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.429 ' HB1' ' HD2' ' A' ' 53' ' ' PRO . . . -162.56 162.24 19.24 Favored Pre-proline 0 N--CA 1.447 -0.576 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -177.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.429 ' HD2' ' HB1' ' A' ' 52' ' ' ALA . 70.5 Cg_endo -72.62 127.18 12.15 Favored 'Trans proline' 0 CA--C 1.514 -0.481 0 C-N-CA 121.161 1.24 . . . . 0.0 113.527 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 pt -110.19 137.75 41.1 Favored 'Isoleucine or valine' 0 C--N 1.358 0.963 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.9 m -64.34 140.57 58.88 Favored 'General case' 0 C--N 1.364 1.234 0 CA-C-O 122.133 0.968 . . . . 0.0 112.002 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -140.71 143.59 35.11 Favored 'General case' 0 N--CA 1.44 -0.933 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -129.75 131.43 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.714 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.475 ' HB3' HD13 ' A' ' 42' ' ' ILE . . . -138.05 130.25 28.89 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.8 p -127.74 154.84 44.89 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-O 122.383 1.087 . . . . 0.0 109.55 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.02 132.13 46.11 Favored 'General case' 0 C--N 1.355 0.833 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.9 m -155.13 148.57 25.11 Favored 'General case' 0 CA--C 1.493 -1.234 0 N-CA-C 103.396 -2.816 . . . . 0.0 103.396 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.8 m -71.26 100.01 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 122.754 1.264 . . . . 0.0 110.134 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.1 p -100.63 163.75 17.52 Favored Pre-proline 0 C--N 1.356 0.877 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -53.29 154.66 13.97 Favored 'Trans proline' 0 C--O 1.208 -1.015 0 C-N-CA 122.037 1.825 . . . . 0.0 115.286 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 54.8 tp -50.03 -50.62 67.93 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -177.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -73.04 -8.35 22.05 Favored 'Trans proline' 0 C--N 1.353 0.804 0 CA-C-N 121.193 1.462 . . . . 0.0 112.339 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.22 24.38 11.2 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.249 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -76.23 70.41 2.86 Favored 'General case' 0 C--N 1.379 1.868 0 CA-C-O 122.241 1.02 . . . . 0.0 108.26 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.6 mtt -120.35 154.35 35.19 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 122.006 0.908 . . . . 0.0 110.068 -177.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 58.8 m -95.33 133.96 38.66 Favored 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.038 -2.208 . . . . 0.0 105.038 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 87.1 mtm180 -112.4 130.81 55.84 Favored 'General case' 0 C--N 1.359 1.016 0 CA-C-N 122.251 2.296 . . . . 0.0 109.318 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.3 t -126.08 135.82 52.18 Favored 'General case' 0 C--N 1.349 0.556 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -115.4 124.3 50.85 Favored 'General case' 0 N--CA 1.437 -1.08 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.2 mt -126.01 125.32 42.47 Favored 'General case' 0 C--N 1.354 0.774 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -101.78 137.59 39.89 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -86.11 113.81 22.47 Favored 'General case' 0 C--N 1.348 0.518 0 O-C-N 121.344 -0.847 . . . . 0.0 109.127 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 41.3 t30 63.89 26.29 14.22 Favored 'General case' 0 C--N 1.372 1.573 0 C-N-CA 123.475 0.71 . . . . 0.0 110.303 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 64.28 25.07 13.47 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 123.397 0.679 . . . . 0.0 111.003 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -94.8 122.52 37.51 Favored 'General case' 0 C--N 1.355 0.816 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.6 -35.65 78.46 Favored 'General case' 0 C--N 1.356 0.849 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -70.47 -17.35 62.98 Favored 'General case' 0 C--N 1.358 0.971 0 O-C-N 121.534 -0.729 . . . . 0.0 110.523 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 79.9 mt -111.99 84.09 1.9 Allowed 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 98.0 m -122.65 131.73 53.94 Favored 'General case' 0 C--N 1.362 1.139 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -108.75 130.74 55.37 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -119.43 107.83 13.81 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 177.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -121.58 119.4 58.82 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.07 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.22 140.75 45.52 Favored 'General case' 0 N--CA 1.428 -1.548 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.3 mp -151.66 160.44 31.7 Favored Pre-proline 0 C--O 1.24 0.589 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 -178.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -52.41 149.46 23.23 Favored 'Trans proline' 0 N--CA 1.484 0.927 0 C-N-CA 122.323 2.015 . . . . 0.0 111.709 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -61.84 -19.91 63.1 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 120.562 -1.336 . . . . 0.0 113.839 -174.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 49.9 p-80 -89.18 -24.52 22.14 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.34 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.01 -29.08 15.41 Favored 'General case' 0 C--N 1.357 0.897 0 O-C-N 121.975 -0.453 . . . . 0.0 111.181 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -63.42 -38.09 89.79 Favored 'General case' 0 C--N 1.36 1.039 0 O-C-N 121.838 -0.538 . . . . 0.0 111.566 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.401 ' O ' HG13 ' A' ' 98' ' ' ILE . 9.2 mp -66.28 -32.58 74.07 Favored 'General case' 0 C--O 1.206 -1.209 0 O-C-N 120.652 -1.28 . . . . 0.0 109.622 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -59.21 -42.45 91.0 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 120.225 1.375 . . . . 0.0 108.974 179.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -63.04 -48.68 77.7 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.916 0.886 . . . . 0.0 109.994 175.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.26 -43.14 99.37 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -176.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 94' ' ' LEU . 0.5 OUTLIER -63.84 -44.54 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 O-C-N 121.244 -0.91 . . . . 0.0 109.753 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -62.75 -40.14 96.31 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.54 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 13.9 ttm -62.49 -50.74 70.22 Favored 'General case' 0 C--N 1.358 0.944 0 C-N-CA 122.366 0.266 . . . . 0.0 110.586 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 84.2 mt -62.57 -44.17 96.98 Favored 'General case' 0 C--N 1.362 1.111 0 CA-C-O 121.546 0.689 . . . . 0.0 109.923 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 60.1 ttm -62.24 -49.02 77.41 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.479 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.41 -49.45 73.93 Favored Glycine 0 C--N 1.359 1.837 0 CA-C-O 118.952 -0.916 . . . . 0.0 115.285 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -85.89 -33.13 21.32 Favored 'General case' 0 C--N 1.363 1.19 0 CA-C-N 120.175 1.987 . . . . 0.0 113.107 -175.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -80.85 -50.22 10.08 Favored 'General case' 0 C--N 1.354 0.786 0 O-C-N 120.449 -1.407 . . . . 0.0 111.392 -176.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -63.82 -43.9 94.85 Favored 'General case' 0 C--N 1.358 0.937 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -177.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.0 mtp -88.41 -17.17 31.04 Favored 'General case' 0 C--N 1.363 1.167 0 O-C-N 121.164 -0.96 . . . . 0.0 110.783 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 62.18 42.58 9.42 Favored 'General case' 0 C--N 1.367 1.356 0 CA-C-O 122.459 1.123 . . . . 0.0 110.74 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.17 144.34 45.79 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 114.3 -1.318 . . . . 0.0 107.895 179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 24.1 p -89.09 -14.21 36.81 Favored 'General case' 0 C--N 1.358 0.964 0 CA-C-O 121.112 0.482 . . . . 0.0 109.708 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -98.85 127.14 44.7 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -85.02 162.36 49.72 Favored Pre-proline 0 C--N 1.35 0.613 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -59.15 148.1 87.41 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 121.568 1.512 . . . . 0.0 113.05 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -37.45 92.13 Favored Glycine 0 C--N 1.359 1.833 0 O-C-N 121.735 -0.603 . . . . 0.0 112.869 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.45 -26.38 63.62 Favored 'General case' 0 C--N 1.357 0.906 0 CA-C-N 118.798 1.299 . . . . 0.0 109.955 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -75.51 -30.78 59.92 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -73.07 -17.21 61.44 Favored 'General case' 0 C--N 1.364 1.211 0 O-C-N 121.42 -0.8 . . . . 0.0 110.541 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -67.61 -42.58 82.18 Favored 'General case' 0 C--N 1.365 1.28 0 CA-C-O 122.761 1.267 . . . . 0.0 107.634 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -64.03 -41.09 97.53 Favored 'General case' 0 C--N 1.357 0.903 0 CA-C-N 113.188 -1.824 . . . . 0.0 110.814 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 3.4 mp -71.25 -40.02 71.26 Favored 'General case' 0 C--N 1.359 0.979 0 O-C-N 122.086 -0.383 . . . . 0.0 110.294 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 56.8 tp -67.9 -39.72 83.56 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 122.729 0.412 . . . . 0.0 109.951 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 103.24 30.97 5.17 Favored Glycine 0 C--N 1.361 1.955 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -103.41 114.97 29.66 Favored 'General case' 0 C--N 1.355 0.806 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -91.89 97.29 10.88 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.8 t . . . . . 0 C--O 1.268 2.067 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.71 179.331 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ttt . . . . . 0 N--CA 1.505 2.304 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -119.32 145.05 46.49 Favored 'General case' 0 C--N 1.361 1.095 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 17.9 pt -59.35 -19.71 16.79 Favored 'Isoleucine or valine' 0 C--N 1.364 1.216 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -79.39 -2.98 44.24 Favored 'General case' 0 C--N 1.365 1.264 0 CA-C-N 120.208 1.367 . . . . 0.0 110.571 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -95.27 -5.29 44.01 Favored 'General case' 0 C--N 1.357 0.916 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -107.1 -112.26 0.29 Allowed 'General case' 0 C--N 1.353 0.751 0 CA-C-O 121.98 0.895 . . . . 0.0 108.778 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.714 HG22 ' HD2' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.0 158.3 44.59 Favored Pre-proline 0 C--N 1.345 0.389 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.714 ' HD2' HG22 ' A' ' 7' ' ' VAL . 81.5 Cg_exo -55.12 128.21 29.58 Favored 'Trans proline' 0 N--CA 1.478 0.577 0 CA-C-N 119.842 0.979 . . . . 0.0 112.257 176.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.06 117.79 18.98 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-O 123.119 1.437 . . . . 0.0 112.326 -175.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -85.64 160.78 52.65 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 113.487 -1.688 . . . . 0.0 106.933 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -57.5 -25.28 65.84 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.441 2.094 . . . . 0.0 113.513 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -74.86 -50.95 15.23 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.33 -46.06 80.09 Favored 'General case' 0 C--N 1.365 1.264 0 C-N-CA 125.201 1.401 . . . . 0.0 110.586 177.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.1 t -61.24 -43.52 96.63 Favored 'Isoleucine or valine' 0 C--N 1.348 0.539 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.866 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.7 m -73.01 -34.49 66.41 Favored 'General case' 0 C--N 1.361 1.078 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.79 -176.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 65.7 mt -71.98 -41.04 68.15 Favored 'General case' 0 C--N 1.367 1.357 0 O-C-N 121.36 -0.838 . . . . 0.0 110.26 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -70.44 -34.71 72.78 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.2 m -49.65 -51.61 58.09 Favored Pre-proline 0 N--CA 1.492 1.665 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -176.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -81.93 125.61 4.83 Favored 'Trans proline' 0 CA--C 1.516 -0.407 0 CA-C-N 121.788 1.674 . . . . 0.0 113.196 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -150.19 160.69 43.49 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.662 -1.607 . . . . 0.0 106.662 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -96.02 146.11 24.9 Favored 'General case' 0 C--N 1.35 0.616 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.6 m -161.52 71.38 0.38 Allowed 'General case' 0 C--N 1.353 0.753 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 178.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -70.61 -40.38 73.23 Favored 'General case' 0 C--N 1.361 1.081 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -160.56 145.72 14.58 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 60.52 -121.76 0.93 Allowed 'General case' 0 C--N 1.366 1.307 0 C-N-CA 122.853 0.461 . . . . 0.0 110.023 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 91.0 mmt-85 -136.41 146.36 46.33 Favored 'General case' 0 C--N 1.358 0.939 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -96.32 126.03 41.24 Favored 'General case' 0 C--N 1.357 0.921 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -65.67 -18.56 65.42 Favored 'General case' 0 C--N 1.358 0.975 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.906 -179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -66.56 -38.63 87.51 Favored 'General case' 0 C--N 1.348 0.535 0 O-C-N 121.906 -0.496 . . . . 0.0 111.83 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.0 tp -62.73 -56.66 27.29 Favored Pre-proline 0 C--N 1.364 1.207 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.71 -19.31 36.55 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 120.94 1.371 . . . . 0.0 114.667 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -70.59 -37.84 73.95 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.31 -27.48 60.73 Favored 'General case' 0 C--N 1.366 1.285 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.2 mt -67.03 -38.18 85.46 Favored 'General case' 0 C--N 1.365 1.26 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.6 m -65.4 -39.81 92.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.125 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.927 HD13 HD11 ' A' ' 42' ' ' ILE . 72.4 mt -69.07 -39.46 79.08 Favored 'General case' 0 C--N 1.358 0.941 0 O-C-N 121.486 -0.759 . . . . 0.0 110.136 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -53.76 -27.05 26.41 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 125.355 1.462 . . . . 0.0 112.823 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -64.34 -11.97 37.61 Favored 'General case' 0 C--N 1.363 1.192 0 O-C-N 121.133 -0.979 . . . . 0.0 112.505 -178.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 121.78 -0.33 10.98 Favored Glycine 0 C--N 1.371 2.499 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.6 m -69.7 -41.65 75.13 Favored 'General case' 0 C--N 1.358 0.936 0 CA-C-N 118.241 1.021 . . . . 0.0 109.647 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 66.18 -178.89 0.2 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.558 0.695 . . . . 0.0 110.852 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.927 HD11 HD13 ' A' ' 36' ' ' LEU . 2.6 mp -135.79 124.88 39.7 Favored 'Isoleucine or valine' 0 C--N 1.358 0.975 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -150.06 126.65 10.91 Favored 'General case' 0 N--CA 1.436 -1.172 0 N-CA-C 103.193 -2.892 . . . . 0.0 103.193 178.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 179.17 -171.02 42.93 Favored Glycine 0 CA--C 1.492 -1.371 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -121.3 115.32 22.76 Favored 'General case' 0 CA--C 1.504 -0.814 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 tpt180 -91.91 130.31 37.7 Favored 'General case' 0 C--N 1.357 0.917 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.82 116.38 20.78 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-O 122.829 1.299 . . . . 0.0 110.478 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.472 HG13 ' HB3' ' A' ' 104' ' ' TYR . 91.5 t -96.91 109.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.132 0 N-CA-C 104.426 -2.435 . . . . 0.0 104.426 176.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -70.49 131.08 43.49 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.4 -7.78 58.35 Favored Glycine 0 C--N 1.359 1.814 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -134.77 -107.88 0.96 Allowed Glycine 0 C--N 1.356 1.654 0 N-CA-C 108.604 -1.799 . . . . 0.0 108.604 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.57 158.38 25.04 Favored Pre-proline 0 N--CA 1.445 -0.699 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -178.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.58 121.62 6.46 Favored 'Trans proline' 0 CA--C 1.513 -0.548 0 C-N-CA 121.179 1.253 . . . . 0.0 112.963 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 3.6 pt -108.31 136.05 45.12 Favored 'Isoleucine or valine' 0 C--N 1.358 0.978 0 CA-C-O 122.217 1.008 . . . . 0.0 108.709 -178.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.0 m -65.28 141.45 58.6 Favored 'General case' 0 C--N 1.364 1.196 0 CA-C-O 122.186 0.993 . . . . 0.0 112.099 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -141.19 145.29 35.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -129.71 130.61 66.84 Favored 'Isoleucine or valine' 0 C--N 1.351 0.664 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -138.56 136.06 35.65 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 105.418 -2.067 . . . . 0.0 105.418 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.2 t -135.09 152.62 51.83 Favored 'General case' 0 CA--C 1.508 -0.67 0 CA-C-O 122.324 1.059 . . . . 0.0 109.562 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -123.72 114.76 20.37 Favored 'General case' 0 C--N 1.353 0.749 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 66.4 p -140.3 161.15 38.36 Favored 'General case' 0 CA--C 1.497 -1.093 0 N-CA-C 104.466 -2.42 . . . . 0.0 104.466 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 1.5 m -79.6 101.24 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.331 0 CA-C-O 122.377 1.084 . . . . 0.0 109.835 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 22.3 p -99.45 161.77 23.47 Favored Pre-proline 0 C--N 1.355 0.821 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_exo -53.64 156.47 11.57 Favored 'Trans proline' 0 C--O 1.207 -1.067 0 C-N-CA 122.145 1.896 . . . . 0.0 115.772 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 61.8 tp -49.24 -53.54 38.38 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 114.571 1.322 . . . . 0.0 114.571 -177.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -73.73 -6.42 18.62 Favored 'Trans proline' 0 C--N 1.353 0.799 0 CA-C-N 121.226 1.474 . . . . 0.0 112.636 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -116.97 25.15 10.71 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.177 -0.92 . . . . 0.0 108.71 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -75.78 68.96 2.4 Favored 'General case' 0 C--N 1.381 1.947 0 CA-C-O 122.195 0.997 . . . . 0.0 108.555 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 59.1 mtt -125.46 152.82 44.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.925 -177.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -90.82 134.05 34.74 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -110.55 131.09 55.35 Favored 'General case' 0 C--N 1.36 1.031 0 CA-C-N 122.063 2.211 . . . . 0.0 109.726 -178.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 11.1 t -124.96 136.66 53.95 Favored 'General case' 0 C--N 1.35 0.602 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 178.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -115.6 123.86 49.5 Favored 'General case' 0 N--CA 1.437 -1.121 0 N-CA-C 105.89 -1.893 . . . . 0.0 105.89 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.0 131.59 52.19 Favored 'General case' 0 C--N 1.354 0.789 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 -178.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -101.71 140.42 36.02 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 107.119 -1.438 . . . . 0.0 107.119 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -85.86 110.7 19.58 Favored 'General case' 0 C--N 1.348 0.52 0 O-C-N 121.356 -0.84 . . . . 0.0 109.077 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.41 26.43 15.76 Favored 'General case' 0 C--N 1.375 1.675 0 C-N-CA 123.702 0.801 . . . . 0.0 110.595 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 67.41 21.77 9.59 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 123.604 0.762 . . . . 0.0 110.959 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -91.28 114.94 27.61 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 178.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.49 -24.71 67.62 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -178.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -74.6 -15.85 60.82 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.372 -0.83 . . . . 0.0 109.337 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.2 mt -116.04 87.49 2.69 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.4 m -120.94 130.65 53.94 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -109.11 133.15 53.38 Favored 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -118.64 108.76 15.33 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 103.388 -2.819 . . . . 0.0 103.388 177.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.4 mm -120.46 118.67 57.41 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.012 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 -176.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -134.99 141.79 46.31 Favored 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 105.481 -2.044 . . . . 0.0 105.481 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.7 mp -151.04 159.06 34.34 Favored Pre-proline 0 C--O 1.239 0.523 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -52.26 149.62 21.91 Favored 'Trans proline' 0 N--CA 1.486 1.079 0 C-N-CA 122.398 2.066 . . . . 0.0 111.973 176.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.22 -19.38 54.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.784 -1.198 . . . . 0.0 113.538 -174.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 21.6 p80 -89.8 -23.74 21.65 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.306 -0.871 . . . . 0.0 109.787 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -94.39 -30.45 14.48 Favored 'General case' 0 C--N 1.361 1.09 0 C-N-CA 123.054 0.541 . . . . 0.0 111.357 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.82 -39.27 93.78 Favored 'General case' 0 C--N 1.361 1.1 0 O-C-N 121.901 -0.499 . . . . 0.0 112.204 -176.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 mp -64.92 -32.92 74.87 Favored 'General case' 0 C--O 1.205 -1.245 0 O-C-N 120.617 -1.302 . . . . 0.0 110.12 -178.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -59.21 -41.69 89.17 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 119.952 1.251 . . . . 0.0 109.26 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -62.29 -48.21 80.88 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 123.81 0.844 . . . . 0.0 109.765 175.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.6 -42.57 99.06 Favored 'General case' 0 C--N 1.359 1.011 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.89 -176.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -64.14 -43.22 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 O-C-N 121.337 -0.852 . . . . 0.0 109.519 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.03 -40.3 95.27 Favored 'General case' 0 C--N 1.363 1.163 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 45.5 ttm -62.85 -49.34 75.27 Favored 'General case' 0 C--N 1.356 0.89 0 CA-C-O 120.884 0.374 . . . . 0.0 111.01 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.23 -45.96 82.56 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 121.457 0.646 . . . . 0.0 109.978 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.4 ttm -62.65 -49.83 73.59 Favored 'General case' 0 C--O 1.217 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.553 -178.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.67 -45.17 96.35 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 121.333 -0.855 . . . . 0.0 113.962 -176.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.472 ' HB3' HG13 ' A' ' 48' ' ' VAL . 59.9 m-85 -86.82 -37.8 17.44 Favored 'General case' 0 C--N 1.358 0.947 0 CA-C-N 119.436 1.618 . . . . 0.0 113.008 -176.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -81.37 -50.7 9.16 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 120.507 -1.37 . . . . 0.0 111.877 -176.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -64.87 -42.58 94.72 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 98.4 mtp -84.01 -22.44 31.33 Favored 'General case' 0 C--N 1.366 1.319 0 O-C-N 120.886 -1.134 . . . . 0.0 110.803 -176.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 59.91 37.81 21.4 Favored 'General case' 0 C--N 1.369 1.425 0 CA-C-O 122.255 1.026 . . . . 0.0 110.921 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 42.3 mtpt -127.83 145.88 50.79 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.591 -1.186 . . . . 0.0 108.405 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.1 t -89.06 -4.35 58.39 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.62 107.92 16.38 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -85.39 151.75 56.77 Favored Pre-proline 0 C--N 1.35 0.592 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -63.19 140.16 76.26 Favored 'Trans proline' 0 N--CA 1.472 0.256 0 C-N-CA 121.544 1.496 . . . . 0.0 113.37 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.49 -37.08 93.54 Favored Glycine 0 C--N 1.357 1.725 0 O-C-N 121.88 -0.513 . . . . 0.0 112.417 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.73 -29.55 65.84 Favored 'General case' 0 C--N 1.359 0.992 0 CA-C-N 118.508 1.154 . . . . 0.0 109.69 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -72.78 -37.75 67.51 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -71.35 -24.75 62.16 Favored 'General case' 0 C--N 1.367 1.344 0 O-C-N 121.818 -0.551 . . . . 0.0 110.401 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 52.5 ttp180 -61.23 -46.5 90.17 Favored 'General case' 0 C--N 1.359 0.979 0 CA-C-O 121.953 0.882 . . . . 0.0 109.501 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 40.9 mmt180 -65.59 -39.58 91.73 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.748 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.18 -43.67 77.64 Favored 'General case' 0 C--N 1.363 1.183 0 O-C-N 121.799 -0.563 . . . . 0.0 110.575 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 59.2 tp -67.88 -41.25 83.08 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 122.766 0.426 . . . . 0.0 110.094 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 90.72 42.19 5.16 Favored Glycine 0 C--N 1.361 1.929 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -102.16 115.11 29.86 Favored 'General case' 0 C--N 1.352 0.698 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -89.58 96.39 10.68 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 24.2 t . . . . . 0 C--O 1.267 2.004 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.293 178.391 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.7 tpt . . . . . 0 N--CA 1.503 2.181 0 CA-C-O 121.713 0.768 . . . . 0.0 112.045 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -109.12 137.02 47.66 Favored 'General case' 0 C--N 1.359 1.005 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 14.2 tt -57.15 -24.68 21.34 Favored 'Isoleucine or valine' 0 C--N 1.367 1.352 0 C-N-CA 123.864 0.866 . . . . 0.0 112.648 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.29 -15.14 63.45 Favored 'General case' 0 C--N 1.355 0.843 0 O-C-N 121.67 -0.643 . . . . 0.0 110.739 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -89.4 -5.68 57.23 Favored 'General case' 0 C--N 1.361 1.083 0 O-C-N 121.623 -0.673 . . . . 0.0 109.555 -179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -101.67 -104.14 0.26 Allowed 'General case' 0 C--N 1.35 0.609 0 CA-C-O 122.089 0.947 . . . . 0.0 109.108 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.591 HG22 ' HD2' ' A' ' 8' ' ' PRO . 3.3 p -89.93 153.99 47.44 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.591 ' HD2' HG22 ' A' ' 7' ' ' VAL . 71.5 Cg_exo -56.78 126.56 22.64 Favored 'Trans proline' 0 C--N 1.349 0.584 0 CA-C-N 119.635 0.905 . . . . 0.0 111.259 175.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.26 119.05 24.09 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.399 1.571 . . . . 0.0 112.563 -175.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -84.1 164.79 42.26 Favored Pre-proline 0 N--CA 1.439 -0.99 0 CA-C-N 112.954 -1.93 . . . . 0.0 106.036 175.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -55.52 -26.94 57.01 Favored 'Trans proline' 0 N--CA 1.486 1.066 0 C-N-CA 122.133 1.888 . . . . 0.0 113.031 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.65 -51.07 25.02 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 124.498 1.119 . . . . 0.0 108.954 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.36 81.58 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.031 1.332 . . . . 0.0 111.04 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 45.6 t -61.26 -44.03 97.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.049 179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 67.5 m -72.42 -36.66 68.64 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.919 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.57 -41.04 69.53 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 121.522 -0.736 . . . . 0.0 110.68 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.429 ' CD1' HD21 ' A' ' 34' ' ' LEU . 72.9 t80 -66.23 -36.07 82.08 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 45.0 m -52.58 -54.76 39.18 Favored Pre-proline 0 N--CA 1.487 1.424 0 N-CA-C 114.714 1.375 . . . . 0.0 114.714 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -76.98 157.86 34.45 Favored 'Trans proline' 0 CA--C 1.516 -0.419 0 CA-C-N 121.486 1.567 . . . . 0.0 114.542 179.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -153.27 160.7 42.8 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -147.32 138.01 23.51 Favored 'General case' 0 C--N 1.352 0.68 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.8 t -157.98 151.79 23.9 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -101.34 12.38 37.54 Favored 'General case' 0 C--N 1.356 0.878 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.96 167.22 22.71 Favored 'General case' 0 C--N 1.352 0.679 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -81.93 58.15 3.77 Favored 'General case' 0 C--N 1.359 1.016 0 O-C-N 121.489 -0.757 . . . . 0.0 110.082 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -159.54 131.85 6.55 Favored 'General case' 0 C--N 1.35 0.604 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -86.45 64.81 8.74 Favored 'General case' 0 C--N 1.357 0.893 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.5 tpt180 -64.72 -43.98 91.66 Favored 'General case' 0 C--N 1.356 0.863 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -74.73 -22.07 59.01 Favored 'General case' 0 C--N 1.359 1.002 0 O-C-N 121.208 -0.932 . . . . 0.0 113.216 -177.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.43 -56.11 38.53 Favored Pre-proline 0 CA--C 1.551 0.994 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.13 -18.12 24.05 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 CA-C-N 121.201 1.465 . . . . 0.0 114.508 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -70.17 -37.26 75.12 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.32 -24.22 57.38 Favored 'General case' 0 C--N 1.359 1.015 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.69 -178.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.429 HD21 ' CD1' ' A' ' 17' ' ' TYR . 94.0 mt -66.83 -38.58 86.7 Favored 'General case' 0 C--N 1.363 1.172 0 O-C-N 121.558 -0.714 . . . . 0.0 109.846 179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.0 t -65.77 -41.12 92.43 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.852 HD13 HD11 ' A' ' 42' ' ' ILE . 80.2 mt -64.59 -39.95 94.65 Favored 'General case' 0 C--N 1.36 1.054 0 O-C-N 121.499 -0.751 . . . . 0.0 109.446 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.62 -21.04 15.83 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.146 1.378 . . . . 0.0 112.647 178.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -70.13 -17.55 63.2 Favored 'General case' 0 C--N 1.362 1.132 0 O-C-N 121.262 -0.899 . . . . 0.0 111.014 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.97 5.2 7.59 Favored Glycine 0 C--N 1.359 1.827 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 33.9 t -69.29 -44.09 72.51 Favored 'General case' 0 C--N 1.359 0.996 0 CA-C-N 118.272 1.036 . . . . 0.0 109.099 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.7 t 67.79 178.27 0.24 Allowed 'General case' 0 C--N 1.373 1.615 0 CA-C-O 121.591 0.71 . . . . 0.0 110.54 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.852 HD11 HD13 ' A' ' 36' ' ' LEU . 2.6 mp -135.08 123.11 39.18 Favored 'Isoleucine or valine' 0 C--N 1.358 0.954 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -150.42 126.67 10.66 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 103.272 -2.862 . . . . 0.0 103.272 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 178.65 -168.91 40.2 Favored Glycine 0 CA--C 1.493 -1.335 0 N-CA-C 108.292 -1.923 . . . . 0.0 108.292 -178.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 37.6 p -121.45 114.51 21.37 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.52 134.27 35.13 Favored 'General case' 0 C--N 1.355 0.839 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 118.62 24.12 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-O 122.746 1.26 . . . . 0.0 110.326 -176.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.498 HG13 ' HB3' ' A' ' 104' ' ' TYR . 87.2 t -98.9 108.67 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.998 0 N-CA-C 104.281 -2.489 . . . . 0.0 104.281 176.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -68.9 129.75 40.82 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 -178.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 101.74 -8.59 56.42 Favored Glycine 0 C--N 1.361 1.918 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -133.91 -107.45 0.98 Allowed Glycine 0 C--N 1.355 1.601 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -160.59 158.6 25.28 Favored Pre-proline 0 N--CA 1.447 -0.592 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -178.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 124.38 8.3 Favored 'Trans proline' 0 CA--C 1.514 -0.514 0 C-N-CA 121.178 1.252 . . . . 0.0 113.035 178.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.8 pt -111.12 139.72 33.75 Favored 'Isoleucine or valine' 0 C--N 1.356 0.866 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.4 p -65.9 144.9 56.51 Favored 'General case' 0 C--N 1.365 1.281 0 CA-C-O 121.746 0.784 . . . . 0.0 111.974 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 19.8 p90 -142.65 143.62 32.43 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.5 t -129.56 129.61 66.81 Favored 'Isoleucine or valine' 0 C--N 1.353 0.736 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -139.09 133.87 32.15 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -132.26 151.58 51.76 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 122.445 1.117 . . . . 0.0 108.754 -178.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -119.29 124.26 46.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 105.58 -2.008 . . . . 0.0 105.58 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.6 m -155.91 144.64 20.34 Favored 'General case' 0 CA--C 1.493 -1.212 0 N-CA-C 103.933 -2.618 . . . . 0.0 103.933 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.438 ' H ' HG22 ' A' ' 62' ' ' VAL . 0.7 OUTLIER -69.57 100.97 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 CA-C-O 122.432 1.111 . . . . 0.0 110.86 -179.59 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -100.76 156.95 34.58 Favored Pre-proline 0 C--N 1.352 0.674 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -46.69 152.33 1.67 Allowed 'Trans proline' 0 C--O 1.204 -1.216 0 C-N-CA 122.907 2.405 . . . . 0.0 117.029 -177.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.8 mp -51.33 -50.9 73.49 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -176.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.07 -5.02 16.27 Favored 'Trans proline' 0 CA--C 1.511 -0.65 0 CA-C-N 121.036 1.406 . . . . 0.0 112.123 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.81 24.65 10.91 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -70.48 68.87 0.38 Allowed 'General case' 0 C--N 1.384 2.098 0 CA-C-O 121.557 0.694 . . . . 0.0 110.323 -178.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 60.1 mtt -124.39 153.93 41.15 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.826 0.822 . . . . 0.0 109.607 -178.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.7 m -94.33 135.61 35.54 Favored 'General case' 0 C--N 1.355 0.822 0 N-CA-C 104.343 -2.465 . . . . 0.0 104.343 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 mtt85 -115.64 129.61 56.56 Favored 'General case' 0 C--N 1.361 1.079 0 CA-C-N 122.167 2.258 . . . . 0.0 109.64 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 9.4 t -123.33 141.23 52.2 Favored 'General case' 0 C--N 1.353 0.725 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -120.12 124.18 45.17 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -126.33 133.65 51.31 Favored 'General case' 0 C--N 1.355 0.838 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -103.88 139.56 38.89 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 178.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -86.24 112.52 21.45 Favored 'General case' 0 C--N 1.343 0.319 0 O-C-N 121.452 -0.78 . . . . 0.0 109.662 -176.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 62.66 25.31 15.05 Favored 'General case' 0 C--N 1.374 1.645 0 C-N-CA 123.717 0.807 . . . . 0.0 110.369 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 66.17 23.82 10.89 Favored 'General case' 0 C--N 1.371 1.509 0 C-N-CA 123.578 0.751 . . . . 0.0 110.693 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -93.44 118.17 30.99 Favored 'General case' 0 C--N 1.353 0.742 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -18.3 65.23 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -85.59 -4.53 59.19 Favored 'General case' 0 C--N 1.357 0.934 0 O-C-N 121.211 -0.931 . . . . 0.0 109.58 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.06 95.33 4.27 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.3 p -126.05 149.6 48.75 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-O 122.115 0.959 . . . . 0.0 109.353 -176.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -126.42 132.24 51.55 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -120.82 108.29 13.76 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 103.194 -2.891 . . . . 0.0 103.194 177.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.6 mm -120.51 118.93 58.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.097 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.32 142.21 45.77 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 105.371 -2.085 . . . . 0.0 105.371 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.5 mp -151.12 159.75 33.12 Favored Pre-proline 0 C--O 1.239 0.541 0 N-CA-C 105.631 -1.988 . . . . 0.0 105.631 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -52.19 149.26 22.41 Favored 'Trans proline' 0 N--CA 1.484 0.953 0 C-N-CA 122.343 2.028 . . . . 0.0 111.502 176.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.21 -18.67 59.44 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 120.633 -1.292 . . . . 0.0 113.727 -174.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -89.7 -22.9 22.0 Favored 'General case' 0 C--N 1.355 0.822 0 O-C-N 121.406 -0.809 . . . . 0.0 109.43 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -94.61 -29.67 14.74 Favored 'General case' 0 C--N 1.357 0.933 0 O-C-N 121.784 -0.573 . . . . 0.0 111.134 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -64.61 -40.79 96.13 Favored 'General case' 0 C--N 1.361 1.082 0 O-C-N 121.944 -0.473 . . . . 0.0 111.857 -176.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.76 -32.83 74.6 Favored 'General case' 0 C--O 1.207 -1.183 0 O-C-N 120.461 -1.4 . . . . 0.0 110.101 -179.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -59.52 -41.31 89.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.136 1.334 . . . . 0.0 108.893 177.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.475 ' HE1' HD11 ' A' ' 120' ' ' LEU . 12.5 t80 -63.2 -48.18 79.44 Favored 'General case' 0 C--N 1.351 0.671 0 C-N-CA 123.622 0.769 . . . . 0.0 110.011 175.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.48 -42.48 96.37 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.607 0.363 . . . . 0.0 111.595 -176.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -63.88 -44.7 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 121.485 -0.759 . . . . 0.0 109.62 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.63 -40.86 96.35 Favored 'General case' 0 C--N 1.363 1.193 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.3 ttp -63.03 -49.21 75.49 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.718 0.407 . . . . 0.0 110.913 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.01 -46.41 78.05 Favored 'General case' 0 C--N 1.357 0.901 0 CA-C-O 121.631 0.729 . . . . 0.0 110.247 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 59.8 ttm -62.45 -49.92 73.52 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.942 -178.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.2 -44.29 97.92 Favored Glycine 0 C--N 1.358 1.79 0 CA-C-O 119.371 -0.683 . . . . 0.0 114.11 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.498 ' HB3' HG13 ' A' ' 48' ' ' VAL . 63.9 m-85 -85.49 -38.13 18.92 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-N 119.387 1.594 . . . . 0.0 112.34 -176.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -78.39 -50.09 12.36 Favored 'General case' 0 C--N 1.355 0.807 0 O-C-N 120.647 -1.283 . . . . 0.0 111.975 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -66.24 -42.34 88.75 Favored 'General case' 0 C--N 1.357 0.896 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -176.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 86.8 mtp -86.33 -22.55 26.64 Favored 'General case' 0 C--N 1.367 1.337 0 O-C-N 120.743 -1.223 . . . . 0.0 110.703 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 62.61 32.51 16.31 Favored 'General case' 0 C--N 1.368 1.402 0 CA-C-O 122.067 0.937 . . . . 0.0 111.148 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -114.41 141.74 47.27 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 6.3 t -86.7 -9.05 56.81 Favored 'General case' 0 C--N 1.362 1.144 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -88.41 121.99 31.42 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -87.76 153.31 52.42 Favored Pre-proline 0 C--N 1.348 0.537 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -63.17 142.1 85.46 Favored 'Trans proline' 0 CA--C 1.519 -0.249 0 C-N-CA 121.611 1.541 . . . . 0.0 113.18 177.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.89 -38.28 95.74 Favored Glycine 0 C--N 1.357 1.701 0 O-C-N 121.82 -0.55 . . . . 0.0 112.585 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.65 -28.6 63.87 Favored 'General case' 0 C--N 1.36 1.043 0 CA-C-N 118.723 1.262 . . . . 0.0 109.652 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -72.65 -34.11 67.04 Favored 'General case' 0 C--N 1.356 0.881 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -73.56 -24.24 60.07 Favored 'General case' 0 C--N 1.355 0.84 0 O-C-N 121.194 -0.941 . . . . 0.0 110.378 -179.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -61.98 -49.94 74.08 Favored 'General case' 0 C--N 1.358 0.977 0 CA-C-O 121.378 0.608 . . . . 0.0 111.314 -178.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.05 -23.96 63.18 Favored 'General case' 0 C--N 1.363 1.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.065 -178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.475 HD11 ' HE1' ' A' ' 96' ' ' TYR . 5.2 mp -84.04 -42.19 16.42 Favored 'General case' 0 C--N 1.362 1.121 0 O-C-N 121.571 -0.706 . . . . 0.0 109.33 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 57.0 tp -68.21 -40.45 82.14 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 88.25 21.44 45.19 Favored Glycine 0 C--N 1.366 2.226 0 N-CA-C 110.236 -1.146 . . . . 0.0 110.236 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -97.08 115.85 28.23 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -84.98 96.47 9.39 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 79.2 p . . . . . 0 C--O 1.264 1.841 0 CA-C-O 117.357 -1.306 . . . . 0.0 111.045 179.905 . . . . . . . . 0 0 . 1 stop_ save_