data_2lfw_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2lfw _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp -72.33 -24.79 61.36 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.983 0.913 . . . . 0.0 111.525 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -61.57 -32.03 79.86 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.683 -0.636 . . . . 0.0 112.503 -175.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -75.49 1.44 14.15 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 117.74 0.77 . . . . 0.0 111.852 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -134.09 4.97 3.54 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.559 0.744 . . . . 0.0 110.169 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -111.87 -46.89 3.19 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.813 0.845 . . . . 0.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.405 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -60.37 -43.74 93.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -177.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.405 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 75.0 Cg_endo -73.06 -1.49 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.049 1.832 . . . . 0.0 112.495 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -135.03 7.79 3.45 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.02 0.528 . . . . 0.0 110.524 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.92 -45.15 99.81 Favored Pre-proline 0 N--CA 1.451 -0.397 0 C-N-CA 124.354 1.061 . . . . 0.0 112.904 -178.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.84 -10.18 16.88 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.935 1.757 . . . . 0.0 112.624 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -65.71 -20.13 66.17 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.953 0.797 . . . . 0.0 111.429 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.1 mt -75.97 -19.09 59.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.72 0.236 . . . . 0.0 110.88 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.28 -18.07 15.63 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.464 0.706 . . . . 0.0 109.666 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.07 -18.74 26.77 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 125.115 1.366 . . . . 0.0 111.231 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -140.39 -14.05 1.0 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 172.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.65 -28.22 71.13 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.21 -10.01 13.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.397 0.679 . . . . 0.0 111.812 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.21 6.31 4.92 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.367 0.667 . . . . 0.0 111.473 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 tp -106.22 -3.91 20.78 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.047 0.539 . . . . 0.0 110.342 178.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 t -147.84 -19.92 0.36 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.022 0.529 . . . . 0.0 111.439 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 22.81 78.67 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.566 -0.574 . . . . 0.0 113.849 172.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.8 t -146.06 134.77 22.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 118.227 1.014 . . . . 0.0 110.204 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -72.14 -26.49 62.12 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.71 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -73.43 -34.04 65.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -77.05 -39.76 48.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 177.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.23 -36.61 92.0 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -72.02 -36.5 69.69 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.667 0.734 . . . . 0.0 111.246 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -22.91 36.57 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.403 -178.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.94 -44.49 63.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.709 0.686 . . . . 0.0 110.357 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.36 -34.69 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-N 118.549 0.613 . . . . 0.0 110.967 -178.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.54 -32.08 47.77 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.937 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.76 -26.71 60.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 175.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 67.4 m -67.01 -37.57 84.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -43.92 44.23 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -62.67 -25.55 68.2 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.96 -0.463 . . . . 0.0 110.571 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.28 0.19 23.05 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.223 0.609 . . . . 0.0 111.648 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.03 -14.31 7.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.41 0.684 . . . . 0.0 109.99 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 38.2 t -58.3 -14.56 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 123.452 0.701 . . . . 0.0 111.527 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.06 2.28 9.28 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.053 0.541 . . . . 0.0 111.53 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.83 54.56 1.05 Allowed Pre-proline 0 CA--C 1.533 0.304 0 C-N-CA 123.008 0.523 . . . . 0.0 111.28 -177.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.08 -10.99 27.74 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.886 2.391 . . . . 0.0 112.479 -177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.97 -9.64 58.83 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.773 0.429 . . . . 0.0 110.906 176.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -96.93 7.21 47.14 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.4 0.68 . . . . 0.0 111.037 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -129.8 60.63 53.04 Favored Pre-proline 0 CA--C 1.533 0.293 0 C-N-CA 122.666 0.386 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.43 ' C ' ' HD3' ' A' ' 48' ' ' ARG . 92.3 Cg_endo -73.7 163.39 37.41 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.785 2.99 . . . . 0.0 111.109 178.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.43 ' HD3' ' C ' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -138.34 3.83 2.39 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.417 0.687 . . . . 0.0 111.072 179.432 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.45 -17.91 63.0 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 m -73.05 -49.14 40.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -164.59 152.3 10.39 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 126.545 1.938 . . . . 0.0 107.127 172.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.9 3.15 4.08 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 123.472 2.781 . . . . 0.0 112.449 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -136.0 -21.25 1.44 Allowed 'General case' 0 C--N 1.341 0.21 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -176.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.6 tp -68.76 -29.52 67.93 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.39 0.541 . . . . 0.0 110.989 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.29 -34.02 33.92 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.52 -42.45 92.28 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.114 0.457 . . . . 0.0 110.185 177.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -77.0 -31.8 56.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.22 -37.86 86.55 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.989 0.359 . . . . 0.0 111.634 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.2 mmm -80.52 -34.76 35.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.314 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -67.38 -42.43 83.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.322 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -72.49 -20.18 61.41 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.434 -0.506 . . . . 0.0 110.584 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.08 -40.36 95.06 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -70.89 -39.0 74.8 Favored 'Isoleucine or valine' 0 C--N 1.338 0.084 0 CA-C-N 117.447 0.624 . . . . 0.0 109.599 177.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -66.93 -40.17 87.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -23.55 62.21 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.415 0.286 . . . . 0.0 111.192 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.4 t -84.14 -20.18 32.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.16 0.184 . . . . 0.0 110.633 177.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.66 -49.14 13.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.379 -0.201 . . . . 0.0 111.385 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.7 p30 -75.2 -13.05 60.42 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.188 -0.32 . . . . 0.0 111.453 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.19 3.21 40.25 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.314 0.646 . . . . 0.0 111.517 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -139.61 3.36 2.08 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.95 0.5 . . . . 0.0 111.359 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.13 4.66 83.94 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 122.978 0.323 . . . . 0.0 112.823 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.48 1.85 18.02 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 117.499 0.65 . . . . 0.0 111.277 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.23 21.42 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.025 0.53 . . . . 0.0 110.608 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -145.6 -176.76 5.25 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.352 1.061 . . . . 0.0 109.084 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -56.62 155.72 7.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.919 0.488 . . . . 0.0 111.137 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.0 p -70.82 168.47 16.69 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.584 0.707 . . . . 0.0 111.895 -177.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -156.15 -166.85 2.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.309 1.043 . . . . 0.0 108.854 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 72.6 p -145.18 168.43 20.41 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.564 0.346 . . . . 0.0 110.98 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -143.06 20.27 1.94 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.256 0.622 . . . . 0.0 111.304 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -130.87 -166.27 1.67 Allowed 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 123.769 0.828 . . . . 0.0 109.882 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -142.39 11.41 1.91 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.75 16.01 0.06 OUTLIER Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.154 -1.022 . . . . 0.0 115.513 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.8 t -147.4 -3.04 0.56 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.173 1.487 . . . . 0.0 113.181 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.49 -31.34 0.11 Allowed 'General case' 0 C--N 1.334 -0.079 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -71.95 -20.17 61.78 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 171.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.3 p -70.24 -29.53 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.04 0.54 55.05 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.646 0.778 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -115.54 -49.02 2.76 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 124.164 0.986 . . . . 0.0 109.937 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.46 -2.17 6.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 112.462 -175.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.2 mtt-85 -128.77 -7.62 5.04 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.171 0.588 . . . . 0.0 111.77 -177.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 mt -140.3 21.99 2.39 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.182 0.593 . . . . 0.0 111.394 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.4 7.63 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.896 1.278 . . . . 0.0 114.078 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -130.2 -3.43 4.45 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.772 0.715 . . . . 0.0 112.649 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 53.4 ttm -73.79 142.65 46.19 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.449 HG21 ' H ' ' A' ' 98' ' ' SER . 12.4 t -61.89 147.35 89.86 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.38 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.59 1.2 0.06 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 125.217 3.945 . . . . 0.0 117.016 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 25.7 tp -129.19 -26.58 2.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.673 1.124 . . . . 0.0 112.739 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.449 ' H ' HG21 ' A' ' 95' ' ' THR . 73.9 m -68.89 -24.02 64.27 Favored 'General case' 0 C--N 1.337 0.062 0 CA-C-N 119.12 0.873 . . . . 0.0 109.751 175.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -72.66 -25.33 61.23 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 122.183 0.193 . . . . 0.0 110.758 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -80.82 -37.41 30.16 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 176.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.81 -29.96 70.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 176.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.22 -48.41 67.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.502 0.321 . . . . 0.0 110.445 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 pp -73.83 -4.72 36.57 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.185 -0.322 . . . . 0.0 111.444 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.2 tp -103.05 -7.31 21.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.214 0.606 . . . . 0.0 112.22 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 82.5 p -140.63 2.05 1.77 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.5 8.51 5.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.807 0.443 . . . . 0.0 110.688 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 5.0 mtm -143.21 -2.7 0.98 Allowed 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.624 0.77 . . . . 0.0 112.338 -178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -139.95 -14.69 1.04 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.471 0.578 . . . . 0.0 112.072 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.56 8.31 25.54 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.015 176.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -63.87 154.81 32.54 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 118.265 1.032 . . . . 0.0 111.312 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 60.9 m -70.79 157.66 89.73 Favored Pre-proline 0 N--CA 1.456 -0.166 0 C-N-CA 123.172 0.589 . . . . 0.0 109.908 178.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -70.23 -16.16 35.5 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.801 2.334 . . . . 0.0 112.076 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.23 -45.01 43.01 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.234 0.47 . . . . 0.0 111.075 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -82.99 -23.61 33.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.39 -30.1 68.94 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 173.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.94 -32.6 63.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -70.28 -22.85 62.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.766 0.427 . . . . 0.0 110.611 175.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.0 tp -83.4 -7.55 59.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 23.5 pt -134.92 11.41 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.775 -0.578 . . . . 0.0 110.369 175.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 54.04 59.85 3.99 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.998 1.319 . . . . 0.0 113.364 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.5 m -138.0 -176.19 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 C-N-CA 124.702 1.201 . . . . 0.0 109.336 176.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -88.66 160.21 17.48 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.6 m -55.97 -40.83 73.84 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 122.745 0.418 . . . . 0.0 111.067 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.5 m -69.81 -20.72 63.44 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.926 0.491 . . . . 0.0 111.787 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.48 -34.38 54.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.424 0.556 . . . . 0.0 110.124 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.3 t -64.98 -36.65 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.061 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.49 -38.45 87.37 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.3 m -71.44 -40.55 70.32 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 119.678 -0.201 . . . . 0.0 110.696 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.02 -34.58 78.34 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.001 0.364 . . . . 0.0 111.82 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -81.17 -27.06 10.61 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.414 0.552 . . . . 0.0 111.032 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 61.6 m -68.95 -37.91 79.12 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -77.13 -25.52 52.18 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 122.275 -0.266 . . . . 0.0 110.658 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.67 -48.4 47.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.399 -0.188 . . . . 0.0 110.557 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.4 -22.61 61.85 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.723 0.238 . . . . 0.0 111.235 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.94 71.34 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.737 0.244 . . . . 0.0 110.371 177.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -75.57 -18.95 59.6 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.875 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.9 mm -78.61 -55.18 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.08 -23.26 67.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.677 0.217 . . . . 0.0 111.194 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.84 -24.35 62.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -158.96 -37.33 0.06 Allowed 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -171.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.7 p . . . . . 0 N--CA 1.47 0.556 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 -169.138 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 . . . . . 0 CA--C 1.528 0.115 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -62.82 -27.78 69.55 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.805 -0.559 . . . . 0.0 111.014 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.34 -37.46 62.97 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.46 -22.11 57.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.44 -0.447 . . . . 0.0 110.85 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.48 -44.23 68.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.856 0.36 . . . . 0.0 110.136 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 68.5 mt -73.71 -37.39 65.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 122.744 0.418 . . . . 0.0 110.095 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.25 -37.76 86.27 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.636 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.1 t -69.49 -37.19 77.11 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 117.74 0.246 . . . . 0.0 111.381 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.89 -30.35 71.45 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 120.545 0.212 . . . . 0.0 111.152 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -105.59 -6.58 19.17 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -67.7 -34.43 76.88 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -57.72 -33.76 68.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.441 0.697 . . . . 0.0 110.345 175.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 23.4 m -67.85 -12.47 60.7 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.183 0.593 . . . . 0.0 112.065 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.406 ' C ' ' H ' ' B' ' 42' ' ' GLU . 44.9 mm -110.2 -12.6 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 118.298 0.499 . . . . 0.0 111.165 -179.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -77.62 25.36 0.19 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.194 0.598 . . . . 0.0 110.991 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.406 ' H ' ' C ' ' B' ' 40' ' ' ILE . 12.6 pt-20 -141.52 176.05 9.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.226 0.61 . . . . 0.0 111.374 -178.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -66.14 178.06 1.25 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.526 1.131 . . . . 0.0 112.326 -177.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -138.25 156.88 73.51 Favored Pre-proline 0 CA--C 1.531 0.216 0 C-N-CA 123.96 0.904 . . . . 0.0 109.923 -178.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -74.55 176.15 10.11 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 123.058 2.505 . . . . 0.0 110.449 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -147.09 -2.21 0.62 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.16 -23.27 67.07 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.807 -0.558 . . . . 0.0 111.802 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.9 mtm -73.16 -35.27 66.42 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 67.7 mt -81.55 -12.32 58.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.713 -0.617 . . . . 0.0 110.084 175.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.0 -20.66 61.68 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 171.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.0 -16.24 62.61 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.987 -0.446 . . . . 0.0 110.417 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' B' ' 54' ' ' LYS . 29.6 mt -90.51 -17.0 27.82 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 173.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -71.47 16.12 0.11 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.014 0.37 . . . . 0.0 111.468 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.486 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -133.8 9.35 3.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.184 0.993 . . . . 0.0 111.171 177.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 pp -153.83 -11.68 0.14 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.215 0 CA-C-N 119.205 0.911 . . . . 0.0 113.262 -179.305 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.6 p . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.77 -35.43 74.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 122.624 0.37 . . . . 0.0 111.251 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.75 -27.25 73.2 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 -176.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -73.89 -1.16 18.44 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.413 0.606 . . . . 0.0 111.421 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -135.37 4.31 3.15 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.407 0.683 . . . . 0.0 110.797 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tt -114.56 -41.25 3.45 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.975 0.51 . . . . 0.0 110.113 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.401 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.98 -44.65 99.79 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.5 Cg_endo -72.61 -2.49 11.91 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.092 1.861 . . . . 0.0 112.521 -178.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -135.01 13.35 3.6 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.995 0.518 . . . . 0.0 110.97 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 45.9 tp -62.09 -39.57 59.35 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -75.77 -11.69 20.1 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.665 1.577 . . . . 0.0 113.316 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.405 ' CE1' HD12 ' B' ' 40' ' ' ILE . 47.8 m-85 -70.26 -22.8 62.84 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.66 0.663 . . . . 0.0 112.553 -173.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.0 -29.8 64.59 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 118.664 0.666 . . . . 0.0 109.59 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -80.51 -28.19 37.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.995 0.518 . . . . 0.0 109.8 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -56.29 -22.53 30.92 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.297 1.039 . . . . 0.0 112.171 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -140.27 -8.83 1.14 Allowed 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 117.812 0.278 . . . . 0.0 111.737 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.86 -28.45 73.06 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -72.29 -4.84 32.03 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.789 0.794 . . . . 0.0 111.655 177.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.45 6.3 5.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.192 0.597 . . . . 0.0 111.374 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.6 tp -99.9 -1.95 36.04 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.208 0.603 . . . . 0.0 110.193 177.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 t -148.05 -0.3 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.889 0.875 . . . . 0.0 110.754 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.98 -0.62 10.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.395 0.998 . . . . 0.0 114.919 173.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.7 m -139.18 134.37 32.69 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.176 1.488 . . . . 0.0 110.086 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -72.31 -23.57 61.19 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.002 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -65.19 -39.19 92.51 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 118.275 0.489 . . . . 0.0 110.501 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -83.43 -31.33 26.68 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.124 0.57 . . . . 0.0 110.127 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.2 -45.68 92.99 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -74.63 -26.4 59.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 117.388 0.594 . . . . 0.0 110.939 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.68 -46.38 72.48 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -64.76 -33.36 75.8 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 117.744 0.247 . . . . 0.0 111.117 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.77 -55.27 24.76 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 117.825 0.284 . . . . 0.0 110.656 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -74.5 -29.17 61.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.119 -176.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -25.04 63.58 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 119.789 -0.148 . . . . 0.0 110.984 177.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.88 -45.67 85.03 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 117.894 0.316 . . . . 0.0 110.231 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.6 tt -80.55 -36.45 33.01 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 119.839 -0.744 . . . . 0.0 111.564 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.94 -27.03 68.54 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.341 0.518 . . . . 0.0 110.242 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.45 -1.19 25.86 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.244 0.618 . . . . 0.0 111.662 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.0 mt -118.98 -13.56 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.725 0.81 . . . . 0.0 110.082 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -58.59 -12.31 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.694 0.798 . . . . 0.0 111.799 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.26 3.3 9.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.321 0.649 . . . . 0.0 111.42 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.41 55.26 1.03 Allowed Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.561 0.745 . . . . 0.0 110.531 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.87 -8.93 21.2 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.512 2.808 . . . . 0.0 112.759 -174.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -80.47 -8.58 59.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.776 0.43 . . . . 0.0 111.403 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -88.44 -17.18 30.97 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.294 0.237 . . . . 0.0 111.633 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.52 120.2 80.66 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -53.69 139.68 67.32 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.282 2.655 . . . . 0.0 112.389 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 54.3 mmm-85 -141.69 16.63 2.16 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.779 1.232 . . . . 0.0 110.084 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -128.17 20.85 6.3 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.95 0.9 . . . . 0.0 110.78 -175.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.2 m -139.37 -178.28 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 124.528 1.131 . . . . 0.0 108.999 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.418 ' C ' ' H ' ' A' ' 53' ' ' ARG . 7.2 m-20 -53.79 146.96 24.75 Favored Pre-proline 0 CA--C 1.531 0.233 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.9 11.31 0.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 123.884 3.056 . . . . 0.0 111.676 -176.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.418 ' H ' ' C ' ' A' ' 51' ' ' ASP . 98.8 mtt180 -127.94 -22.21 3.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.631 0.773 . . . . 0.0 111.022 177.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.8 tp -74.42 -34.36 63.21 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.173 0.442 . . . . 0.0 110.251 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.71 -30.4 61.89 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.43 -43.58 93.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.203 0.601 . . . . 0.0 110.111 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -81.01 -29.78 35.08 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -177.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.24 -40.63 90.37 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 117.897 0.317 . . . . 0.0 111.129 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.3 mmm -74.94 -35.74 62.13 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -66.75 -35.91 81.21 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 117.529 0.149 . . . . 0.0 110.647 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -68.71 -27.36 65.88 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.866 0.466 . . . . 0.0 110.017 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.58 -37.32 84.96 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.593 -0.603 . . . . 0.0 111.593 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.7 mm -72.39 -38.91 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.067 0 CA-C-N 118.014 0.907 . . . . 0.0 110.323 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -69.74 -35.5 75.03 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.23 -0.294 . . . . 0.0 110.584 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.31 -28.15 66.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 122.166 -0.333 . . . . 0.0 110.58 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -80.34 -28.06 38.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.429 0.291 . . . . 0.0 110.878 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.63 -32.26 67.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.227 -0.295 . . . . 0.0 111.11 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -87.01 -12.49 47.26 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.406 0.282 . . . . 0.0 110.876 177.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.8 5.55 43.09 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.183 0.593 . . . . 0.0 110.877 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -134.99 1.75 3.03 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.27 0.628 . . . . 0.0 111.027 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.58 25.97 74.97 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-O 119.618 -0.545 . . . . 0.0 112.572 176.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -61.58 -16.35 47.31 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.847 0.823 . . . . 0.0 111.17 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.23 164.2 39.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.561 0.744 . . . . 0.0 110.305 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -141.35 4.27 1.78 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.844 0.858 . . . . 0.0 110.513 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.1 t -159.27 -172.15 3.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.254 1.021 . . . . 0.0 108.921 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.41 ' C ' ' H ' ' A' ' 78' ' ' SER . 87.0 p -130.61 -19.0 3.06 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.225 -0.417 . . . . 0.0 111.609 177.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 58.04 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 174.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 76' ' ' SER . 74.2 m 57.41 168.72 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.899 1.28 . . . . 0.0 113.215 -171.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -149.7 16.26 0.88 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.466 0.706 . . . . 0.0 110.936 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.92 -176.39 4.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.925 0.49 . . . . 0.0 110.289 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -138.87 7.56 2.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.753 0.421 . . . . 0.0 111.857 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -172.51 12.42 0.04 OUTLIER Glycine 0 CA--C 1.529 0.918 0 CA-C-O 119.208 -0.774 . . . . 0.0 114.44 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.7 t -145.93 -0.63 0.8 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.845 1.322 . . . . 0.0 112.81 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -149.68 -45.92 0.13 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.08 -24.37 67.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.24 -28.59 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 O-C-N 122.117 -0.364 . . . . 0.0 110.545 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.63 -0.35 56.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.76 -21.09 2.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 118.168 0.44 . . . . 0.0 111.867 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -81.11 -1.94 46.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.071 0.548 . . . . 0.0 110.962 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -129.19 -9.97 4.74 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.111 0.564 . . . . 0.0 111.734 -177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.8 mp -126.16 7.01 7.16 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.839 0.856 . . . . 0.0 111.43 -174.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.13 -9.31 1.96 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -75.21 -0.82 20.72 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.017 0.527 . . . . 0.0 111.225 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 72.0 mtm -121.13 162.48 20.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 122.94 0.496 . . . . 0.0 111.238 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.473 ' C ' ' H ' ' A' ' 97' ' ' LEU . 28.6 m -67.29 144.21 97.95 Favored Pre-proline 0 N--CA 1.453 -0.303 0 C-N-CA 123.749 0.819 . . . . 0.0 110.585 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -54.59 5.26 0.04 OUTLIER 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 124.829 3.686 . . . . 0.0 115.344 173.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.473 ' H ' ' C ' ' A' ' 95' ' ' THR . 3.3 tm? -123.71 -37.25 2.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.462 0.574 . . . . 0.0 110.086 -174.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 p -67.68 -20.79 65.33 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.307 0.503 . . . . 0.0 110.257 175.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 33.6 mtp-105 -71.7 -23.56 61.66 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.656 0.207 . . . . 0.0 110.839 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -78.99 -38.07 37.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -66.27 -29.78 70.07 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.91 -51.3 67.47 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.86 -4.92 37.84 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 71.2 mt -95.3 -7.43 38.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.26 0.482 . . . . 0.0 111.951 174.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 65.1 p -136.07 8.12 3.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.558 0.617 . . . . 0.0 112.488 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.09 7.66 2.68 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.929 0.491 . . . . 0.0 110.847 176.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.5 tpp -136.05 -15.07 1.77 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -150.6 -21.81 0.23 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.437 0.562 . . . . 0.0 112.397 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 84.32 19.86 59.82 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 119.396 -0.669 . . . . 0.0 113.615 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -56.7 148.51 20.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.371 1.085 . . . . 0.0 110.708 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.3 m -72.68 153.41 91.49 Favored Pre-proline 0 CA--C 1.53 0.206 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -52.65 -30.11 44.34 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.459 2.773 . . . . 0.0 113.252 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.03 -33.9 72.59 Favored 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.749 -0.594 . . . . 0.0 110.808 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -83.26 -36.7 24.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.17 -31.04 68.34 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.916 -0.129 . . . . 0.0 111.24 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.32 -36.54 61.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.879 0.309 . . . . 0.0 110.794 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -69.41 -23.07 63.65 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.78 0.432 . . . . 0.0 111.211 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 23.6 tp -87.7 -3.29 58.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.981 0.512 . . . . 0.0 111.782 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.0 pt -134.38 10.66 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.986 -0.446 . . . . 0.0 110.793 178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 59.43 50.89 7.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.444 1.098 . . . . 0.0 113.561 173.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 28.7 m -136.03 174.66 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 C-N-CA 123.482 0.713 . . . . 0.0 110.189 175.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.17 157.38 36.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.8 m -59.46 -36.58 76.24 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.138 -0.351 . . . . 0.0 110.99 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.7 t -74.28 -23.81 59.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.004 -0.435 . . . . 0.0 111.072 -179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.35 -42.5 65.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.963 -0.461 . . . . 0.0 110.621 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.4 p -68.11 -29.68 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.454 -178.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.23 -37.94 87.28 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 176.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 88.8 m -77.11 -36.53 55.52 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 122.382 -0.199 . . . . 0.0 110.488 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.14 -30.78 71.33 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.135 -0.459 . . . . 0.0 111.505 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.0 m -82.77 -27.69 8.31 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 118.903 0.774 . . . . 0.0 110.805 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 84.5 m -68.1 -38.71 82.6 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -76.7 -27.02 55.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 122.125 -0.359 . . . . 0.0 110.615 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.42 -49.06 45.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.23 -22.92 63.82 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 122.152 -0.342 . . . . 0.0 111.303 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.79 71.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -75.84 -18.9 59.28 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.532 -0.27 . . . . 0.0 111.105 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.0 mm -75.54 -55.38 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 118.402 0.546 . . . . 0.0 109.597 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -65.34 -18.42 65.3 Favored 'General case' 0 CA--C 1.527 0.083 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -75.19 -22.07 58.26 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -159.71 -37.45 0.06 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -171.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.468 0.47 0 C-N-CA 123.822 0.849 . . . . 0.0 112.517 -169.599 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 CA--C 1.53 0.21 0 CA-C-O 120.59 0.233 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -59.35 -28.06 66.5 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.275 0.63 . . . . 0.0 112.017 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -69.07 -30.46 72.05 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.43 -15.73 48.54 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.738 0.769 . . . . 0.0 110.687 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.33 -46.31 16.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 mt -68.94 -38.7 79.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.695 177.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -67.69 -29.2 68.41 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.155 -0.45 . . . . 0.0 110.921 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.1 t -67.73 -44.45 77.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.728 0.695 . . . . 0.0 110.312 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.2 -24.41 67.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.248 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -107.44 -9.51 15.96 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -70.36 -36.07 73.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 173.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -69.2 -21.23 63.97 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.24 -0.288 . . . . 0.0 111.143 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 58.7 m -75.79 -10.8 59.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.274 0.629 . . . . 0.0 111.389 177.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.405 HD12 ' CE1' ' A' ' 13' ' ' PHE . 19.1 tt -123.94 30.03 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 122.181 0.991 . . . . 0.0 110.018 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -128.41 28.91 5.39 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.43 0.692 . . . . 0.0 109.574 176.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -142.46 -176.24 4.77 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.662 0.785 . . . . 0.0 110.279 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -60.34 178.79 0.18 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.07 0.948 . . . . 0.0 112.91 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.07 155.64 74.35 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.238 -175.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -76.8 59.09 6.24 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 124.499 3.466 . . . . 0.0 110.533 175.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -59.85 -9.51 2.99 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.609 0.764 . . . . 0.0 111.607 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -56.62 -23.37 40.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.242 0.617 . . . . 0.0 111.619 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 19.3 ptp -75.92 -29.08 58.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.844 -0.535 . . . . 0.0 110.813 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 64.4 mt -80.39 -11.19 59.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 121.615 -0.678 . . . . 0.0 109.461 174.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.78 -20.29 61.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 168.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 50.4 mt -78.45 -8.53 58.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.432 0.293 . . . . 0.0 110.247 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.408 ' C ' ' H ' ' B' ' 54' ' ' LYS . 2.7 mm? -90.42 -18.77 24.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 171.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -74.24 13.7 0.53 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.665 0.386 . . . . 0.0 111.251 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.408 ' H ' ' C ' ' B' ' 52' ' ' LEU . 58.8 pttt -130.97 13.3 5.24 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.119 0.968 . . . . 0.0 109.894 174.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.3 mt -137.5 -26.87 0.97 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.533 0.733 . . . . 0.0 111.394 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.233 0 CA-C-N 117.884 0.311 . . . . 0.0 111.581 -179.861 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 CA--C 1.53 0.208 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.9 tp 61.43 -38.9 0.12 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.476 2.31 . . . . 0.0 114.847 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.6 -24.92 64.05 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 119.105 0.866 . . . . 0.0 112.51 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -68.85 -2.1 8.79 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 117.597 0.698 . . . . 0.0 111.126 177.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -131.01 -21.49 2.67 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.253 0.621 . . . . 0.0 110.974 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 tp -77.91 -44.87 25.74 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.138 -0.351 . . . . 0.0 110.36 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.29 -46.26 99.84 Favored Pre-proline 0 CA--C 1.534 0.346 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -173.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.69 -0.24 9.57 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.307 2.005 . . . . 0.0 112.541 -176.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -133.65 13.29 4.07 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.411 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 42.2 mt -55.05 -43.54 99.12 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.411 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 69.5 Cg_endo -81.12 -12.54 11.74 Favored 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 121.919 1.746 . . . . 0.0 114.016 -170.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -66.03 -23.15 66.5 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 119.123 0.874 . . . . 0.0 111.843 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 mp -69.76 -18.85 63.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 118.089 0.404 . . . . 0.0 110.557 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -98.27 -20.7 17.08 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -58.24 -22.26 51.57 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 123.682 0.793 . . . . 0.0 111.57 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -140.09 -24.93 0.81 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.247 0.219 . . . . 0.0 111.3 177.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -61.33 -29.0 70.27 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -65.47 -32.77 74.57 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.114 0.457 . . . . 0.0 110.635 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.47 -6.21 52.69 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.485 0.314 . . . . 0.0 111.833 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.0 mt -97.44 4.7 50.47 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -155.36 -15.8 0.11 Allowed 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.06 25.34 75.49 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.577 -0.702 . . . . 0.0 112.758 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.4 t -150.67 139.95 21.29 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.188 0.994 . . . . 0.0 110.948 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -81.16 -20.2 41.79 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.425 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -71.82 -36.54 70.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -76.63 -32.3 57.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.22 -43.31 89.55 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -67.92 -31.94 72.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 117.071 0.435 . . . . 0.0 110.633 178.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -71.27 -42.51 68.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.379 0.272 . . . . 0.0 110.406 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -65.3 -41.41 94.13 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.576 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.0 m -68.61 -37.7 78.0 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.127 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.327 -176.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -78.8 -29.8 45.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.577 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.32 -26.58 62.0 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.302 -0.259 . . . . 0.0 110.302 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.2 m -65.59 -40.82 93.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.45 -41.78 54.89 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 110.272 -0.269 . . . . 0.0 110.272 -176.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.92 -24.95 68.09 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.903 -0.498 . . . . 0.0 110.649 -178.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.75 0.46 26.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.39 0.676 . . . . 0.0 111.594 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.1 mt -122.41 -14.85 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.112 0.965 . . . . 0.0 109.977 -176.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.8 -14.83 7.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.463 0.705 . . . . 0.0 111.053 175.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.69 4.41 9.51 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.413 0.685 . . . . 0.0 110.933 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.74 53.05 0.89 Allowed Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.39 0.676 . . . . 0.0 111.295 -176.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -65.01 -10.72 26.62 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.24 2.627 . . . . 0.0 112.55 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -74.87 -13.84 60.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.53 0.332 . . . . 0.0 111.255 176.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -90.05 2.8 54.8 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.048 0.539 . . . . 0.0 111.533 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -133.77 65.08 69.84 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 122.483 0.313 . . . . 0.0 111.135 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -76.39 179.95 5.89 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 124.681 3.587 . . . . 0.0 111.396 -175.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.43 ' C ' ' H ' ' A' ' 50' ' ' VAL . 78.7 mmt-85 -132.56 16.42 4.4 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.662 1.185 . . . . 0.0 109.823 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -71.86 8.89 1.04 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.185 0.994 . . . . 0.0 110.902 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.43 ' H ' ' C ' ' A' ' 48' ' ' ARG . 27.3 m -133.63 178.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 C-N-CA 124.974 1.309 . . . . 0.0 108.693 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.421 ' C ' ' H ' ' A' ' 53' ' ' ARG . 6.9 m-20 -53.73 146.09 27.88 Favored Pre-proline 0 CA--C 1.529 0.166 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -70.18 10.77 0.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.979 3.119 . . . . 0.0 111.983 -175.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.421 ' H ' ' C ' ' A' ' 51' ' ' ASP . 68.5 mtp180 -132.63 -17.53 2.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.325 0.65 . . . . 0.0 111.127 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 54.1 tp -75.93 -36.41 59.4 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.374 0.534 . . . . 0.0 110.558 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.81 -32.07 54.51 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -58.6 -42.84 89.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.768 0.827 . . . . 0.0 109.854 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 -79.61 -28.6 40.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -66.94 -41.27 87.26 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.242 0.474 . . . . 0.0 111.257 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 93.4 mmm -75.37 -32.27 60.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.241 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -68.67 -35.93 77.87 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.92 -26.86 67.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.773 0.429 . . . . 0.0 110.117 177.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.84 -38.36 65.69 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.7 mm -74.44 -35.98 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 CA-C-N 117.886 0.843 . . . . 0.0 110.046 177.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -67.68 -32.15 72.62 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.501 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.22 -32.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.937 -0.477 . . . . 0.0 110.207 175.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.1 t -73.22 -26.37 61.11 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.74 -30.86 51.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.334 0.253 . . . . 0.0 110.454 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -76.65 -15.12 59.9 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.107 -0.371 . . . . 0.0 110.314 173.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -93.05 7.58 43.54 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.608 0.763 . . . . 0.0 110.628 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -138.31 0.54 2.11 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.287 0.635 . . . . 0.0 111.39 -179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.92 33.2 46.76 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.641 -0.533 . . . . 0.0 112.525 175.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -123.47 10.7 9.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.017 0.909 . . . . 0.0 111.253 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.73 24.28 1.53 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.874 0.469 . . . . 0.0 111.205 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -102.66 6.3 39.55 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.07 0.548 . . . . 0.0 110.809 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.8 t -155.08 174.37 15.27 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.497 0.719 . . . . 0.0 109.824 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -154.15 176.4 12.3 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.305 0.642 . . . . 0.0 110.816 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -145.94 -12.82 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.972 0.509 . . . . 0.0 112.009 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 m 61.5 168.16 0.1 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.663 1.185 . . . . 0.0 112.817 -173.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -144.69 14.42 1.56 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.03 0.932 . . . . 0.0 110.507 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.3 -179.3 6.75 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.919 0.888 . . . . 0.0 109.578 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -136.34 11.98 3.26 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.441 0.296 . . . . 0.0 111.707 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -164.27 12.08 0.09 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 119.394 -0.67 . . . . 0.0 113.827 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -149.78 7.91 0.66 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 1.127 . . . . 0.0 111.63 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -150.3 -48.24 0.13 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.35 -28.21 41.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 122.553 0.341 . . . . 0.0 110.819 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.8 0.76 55.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.096 0.558 . . . . 0.0 111.926 -178.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -121.48 -39.89 2.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.861 0.465 . . . . 0.0 110.012 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.35 -1.31 7.93 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -130.11 -2.95 4.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.221 0.608 . . . . 0.0 111.337 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 61.8 mt -137.52 20.17 2.91 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.918 0.887 . . . . 0.0 111.13 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.06 4.49 0.05 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -175.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -129.4 0.47 5.06 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.091 0.86 . . . . 0.0 112.085 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 54.5 ttm -71.55 149.55 45.61 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.8 m -57.43 140.11 79.92 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 123.648 0.779 . . . . 0.0 109.707 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.54 5.4 0.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.031 3.154 . . . . 0.0 113.919 -176.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.3 tp -128.97 -22.99 3.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.477 0.581 . . . . 0.0 110.682 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 71.0 m -69.32 -22.89 63.75 Favored 'General case' 0 N--CA 1.457 -0.075 0 O-C-N 121.891 -0.505 . . . . 0.0 109.922 174.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 40.4 mtp-105 -68.05 -32.54 72.96 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 175.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -76.39 -39.0 54.88 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.07 -30.45 71.52 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.1 tp -66.84 -46.59 74.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.402 0.281 . . . . 0.0 110.283 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.0 mt -74.89 -8.94 57.97 Favored 'General case' 0 N--CA 1.46 0.04 0 O-C-N 122.13 -0.356 . . . . 0.0 110.73 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -95.67 -8.4 34.83 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -140.65 -20.34 0.83 Allowed 'General case' 0 C--N 1.339 0.121 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.53 -10.85 58.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.121 0.873 . . . . 0.0 111.591 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 16.1 ptp -149.83 11.3 0.74 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -174.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -138.08 -13.13 1.42 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.856 0.753 . . . . 0.0 112.15 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.84 10.04 36.59 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.009 -0.884 . . . . 0.0 114.493 173.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -59.2 150.44 25.53 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 118.808 1.304 . . . . 0.0 110.132 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 94.4 p -67.87 157.19 87.44 Favored Pre-proline 0 N--CA 1.454 -0.235 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.246 179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -69.45 -16.17 38.7 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 122.775 2.317 . . . . 0.0 110.866 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -79.16 -44.73 21.37 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.63 0.372 . . . . 0.0 110.733 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -78.67 -27.52 45.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.959 -0.463 . . . . 0.0 109.865 177.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.96 -27.64 64.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.905 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.64 -32.55 60.26 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 110.423 -0.214 . . . . 0.0 110.423 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -70.02 -28.95 65.91 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.635 0.374 . . . . 0.0 110.349 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 17.3 tp -76.87 -9.04 58.41 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 21.1 pt -134.98 12.29 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 117.931 0.332 . . . . 0.0 110.812 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 52.34 60.8 3.56 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.904 1.281 . . . . 0.0 113.7 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.36 -175.28 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.43 1.092 . . . . 0.0 109.492 175.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -88.4 160.64 17.48 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.8 m -56.32 -40.49 74.48 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 122.115 -0.365 . . . . 0.0 111.341 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 51.9 m -70.54 -20.54 62.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.688 0.395 . . . . 0.0 111.907 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.91 -37.7 62.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 121.954 -0.466 . . . . 0.0 109.834 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.63 -38.68 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.01 -33.02 74.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.79 -0.078 . . . . 0.0 110.79 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 91.4 m -78.12 -39.66 40.6 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -34.03 77.42 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 119.331 -0.366 . . . . 0.0 111.184 -179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.5 m -80.49 -27.54 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 CA-C-N 118.515 0.598 . . . . 0.0 110.993 178.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.9 m -69.23 -38.78 78.7 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 178.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -76.04 -25.65 55.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.28 -47.85 46.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 117.674 0.216 . . . . 0.0 110.432 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.7 -22.77 65.25 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.337 0.517 . . . . 0.0 111.264 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -77.41 -34.38 54.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.91 0.386 . . . . 0.0 110.587 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -77.39 -27.46 52.49 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 123.366 0.666 . . . . 0.0 110.094 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.9 mm -66.66 -60.07 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.19 -23.69 67.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -171.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -71.9 -10.2 59.44 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -151.53 -50.07 0.12 Allowed 'General case' 0 C--N 1.34 0.19 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 42.9 p . . . . . 0 N--CA 1.47 0.554 0 C-N-CA 127.698 2.399 . . . . 0.0 117.371 -171.995 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 CA--C 1.527 0.061 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.7 tpt -67.02 -25.23 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.708 0.686 . . . . 0.0 110.707 178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.6 -29.55 65.52 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.14 -27.08 59.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 117.234 0.517 . . . . 0.0 110.549 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.67 -41.52 71.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.38 -43.01 70.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.013 0.525 . . . . 0.0 110.341 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -69.43 -29.79 67.59 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 119.041 -0.505 . . . . 0.0 111.246 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.2 t -65.9 -43.59 87.76 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 118.863 0.756 . . . . 0.0 110.191 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.56 71.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.595 0.236 . . . . 0.0 110.666 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -100.49 -3.13 31.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.183 -0.323 . . . . 0.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -70.42 -31.95 69.36 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -62.86 -33.0 74.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 172.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 20.6 m -81.22 -4.06 54.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.756 0.823 . . . . 0.0 113.101 -177.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 10.4 tp -119.54 -12.02 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 119.166 0.893 . . . . 0.0 112.262 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -83.18 -3.68 57.62 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.897 -0.502 . . . . 0.0 111.172 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.78 170.58 15.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.612 0.72 . . . . 0.0 111.799 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -71.89 -173.76 1.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.068 0.947 . . . . 0.0 110.284 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.9 m -131.58 149.46 73.56 Favored Pre-proline 0 C--O 1.232 0.161 0 C-N-CA 122.608 0.363 . . . . 0.0 110.114 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' B' ' 47' ' ' GLU . 89.1 Cg_endo -76.5 -27.86 7.3 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.291 2.661 . . . . 0.0 113.437 -175.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.5 t70 52.53 -2.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.038 1.735 . . . . 0.0 115.138 -178.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' B' ' 45' ' ' PRO . 14.5 pt-20 -67.54 -17.04 64.5 Favored 'General case' 0 N--CA 1.457 -0.111 0 O-C-N 121.112 -0.992 . . . . 0.0 111.399 -178.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 28.1 mtm -71.05 -31.25 67.64 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.324 -0.235 . . . . 0.0 110.401 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -85.87 -9.72 56.51 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.977 -0.452 . . . . 0.0 109.959 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -73.13 -20.21 60.97 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.708 -0.62 . . . . 0.0 109.552 169.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 80.9 mt -77.22 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.566 0.346 . . . . 0.0 110.245 173.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -88.51 -18.59 27.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.764 0.425 . . . . 0.0 109.957 171.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -77.89 18.07 0.52 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.196 0.598 . . . . 0.0 111.867 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -133.5 1.35 3.41 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.769 0.428 . . . . 0.0 111.919 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 pp -154.16 2.59 0.24 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.208 0 CA-C-N 118.605 0.639 . . . . 0.0 112.201 179.199 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.4 p . . . . . 0 CA--C 1.529 0.144 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.94 -35.63 66.86 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.79 0.436 . . . . 0.0 111.527 -178.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.53 -36.02 92.81 Favored Glycine 0 C--N 1.341 0.814 0 O-C-N 121.692 -0.63 . . . . 0.0 111.69 -177.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -73.77 1.87 9.54 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.612 0.765 . . . . 0.0 111.309 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -130.84 1.92 4.38 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.674 0.79 . . . . 0.0 110.955 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.34 -38.15 4.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.293 0.637 . . . . 0.0 109.865 177.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.415 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.29 -43.42 96.62 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.7 Cg_endo -73.34 -1.17 10.23 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.357 2.038 . . . . 0.0 112.867 -176.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -134.14 8.74 3.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.248 0.619 . . . . 0.0 110.409 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.75 -41.87 88.17 Favored Pre-proline 0 N--CA 1.452 -0.362 0 C-N-CA 125.362 1.465 . . . . 0.0 114.141 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.28 -10.76 14.84 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.818 1.679 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -66.94 -20.45 65.9 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.753 -0.592 . . . . 0.0 111.059 -177.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.0 mt -71.8 -21.63 61.68 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.095 0.407 . . . . 0.0 110.71 178.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -94.57 -22.19 18.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -55.8 -27.52 51.55 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 124.579 1.152 . . . . 0.0 111.674 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.9 p90 -140.09 -18.89 0.9 Allowed 'General case' 0 N--CA 1.458 -0.074 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.51 -25.74 74.63 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -81.8 -9.52 59.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.377 0.588 . . . . 0.0 110.978 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -109.4 -1.32 18.5 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.616 0.767 . . . . 0.0 110.497 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.5 tp -89.83 5.96 43.88 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.091 0.956 . . . . 0.0 109.444 175.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.2 p -142.28 -14.26 0.79 Allowed 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.696 0.799 . . . . 0.0 111.902 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.453 ' HA3' ' H ' ' A' ' 77' ' ' GLN . . . 64.04 13.86 54.27 Favored Glycine 0 CA--C 1.53 1.031 0 CA-C-O 119.619 -0.545 . . . . 0.0 112.965 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.5 t -142.06 133.25 26.24 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.887 0.843 . . . . 0.0 110.332 -178.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -70.54 -27.16 63.95 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.168 -177.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -75.03 -35.88 61.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.52 -0.112 . . . . 0.0 110.798 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -75.92 -32.4 59.58 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.504 -0.122 . . . . 0.0 110.894 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.3 -42.45 42.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -71.91 -27.89 63.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.591 0.696 . . . . 0.0 111.375 -177.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.71 -26.28 34.76 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.782 0.719 . . . . 0.0 111.747 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -73.8 -31.21 63.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.812 0.733 . . . . 0.0 109.897 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.6 t -63.92 -51.88 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -73.99 -27.78 61.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.409 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.98 -25.09 61.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 117.461 0.118 . . . . 0.0 110.734 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 69.3 m -65.02 -45.37 85.81 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 119.093 -0.479 . . . . 0.0 110.327 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.88 -35.18 67.1 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.605 -178.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -62.91 -23.95 67.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.532 -0.73 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.8 -0.1 33.11 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.82 0.448 . . . . 0.0 111.687 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 19.5 mm -110.87 -19.55 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.373 0.669 . . . . 0.0 109.494 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.68 -13.76 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 124.137 0.975 . . . . 0.0 113.076 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 2.24 9.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.859 -0.526 . . . . 0.0 111.181 -178.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -160.55 59.17 1.15 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 C-N-CA 123.136 0.574 . . . . 0.0 110.419 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -65.28 -10.72 27.02 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.441 2.761 . . . . 0.0 112.679 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -76.35 -13.12 60.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.963 0.505 . . . . 0.0 111.446 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -80.11 -22.62 41.94 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.044 0.383 . . . . 0.0 111.463 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -78.36 121.59 83.99 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -50.44 142.55 29.87 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.558 2.839 . . . . 0.0 112.998 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.0 mmt85 -134.98 8.94 3.52 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.934 0.894 . . . . 0.0 109.433 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -139.69 20.82 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.506 1.122 . . . . 0.0 110.819 -173.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 t -133.4 170.57 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -53.26 144.54 29.53 Favored Pre-proline 0 N--CA 1.455 -0.209 0 O-C-N 122.127 -0.358 . . . . 0.0 110.604 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.9 11.87 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 124.176 3.251 . . . . 0.0 112.008 -175.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -131.14 -27.08 2.06 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.378 0.671 . . . . 0.0 110.512 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.54 -36.86 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.05 -0.406 . . . . 0.0 110.261 177.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.13 -32.95 65.3 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -58.91 -45.25 90.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.283 0.633 . . . . 0.0 109.718 175.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -76.07 -25.92 55.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.895 -176.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -68.67 -42.54 77.74 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.534 0.607 . . . . 0.0 111.624 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 81.3 mmm -73.21 -33.52 65.42 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.488 0.585 . . . . 0.0 110.948 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -67.78 -38.92 84.01 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.495 177.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -66.86 -25.3 66.34 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.21 -36.92 71.57 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.3 mm -70.38 -41.02 78.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 117.794 0.797 . . . . 0.0 110.011 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -70.21 -34.03 72.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.643 -0.132 . . . . 0.0 110.643 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.35 -33.46 74.32 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.053 -0.404 . . . . 0.0 110.437 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.2 t -73.36 -30.63 63.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.14 -28.02 65.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.317 0.247 . . . . 0.0 111.024 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -89.43 -13.2 38.18 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.424 0.289 . . . . 0.0 110.934 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.84 2.03 47.44 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.011 0.525 . . . . 0.0 111.751 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -140.09 2.35 1.91 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.635 0.374 . . . . 0.0 111.275 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.05 85.68 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.944 -0.473 . . . . 0.0 113.228 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.16 -11.76 51.42 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 117.835 0.817 . . . . 0.0 111.668 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.09 135.7 12.48 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.416 0.686 . . . . 0.0 109.333 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -148.99 4.04 0.62 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.359 0.664 . . . . 0.0 111.368 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -158.43 -172.77 3.99 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.939 0.496 . . . . 0.0 110.159 -175.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.0 p -138.44 -177.27 4.78 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.536 0.734 . . . . 0.0 110.222 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.628 ' HG2' ' H ' ' A' ' 78' ' ' SER . 33.7 tt0 -139.44 -170.03 2.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 122.862 0.465 . . . . 0.0 110.286 -174.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.628 ' H ' ' HG2' ' A' ' 77' ' ' GLN . 66.1 m -130.97 50.98 2.18 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.798 0.839 . . . . 0.0 110.311 -176.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -70.57 25.87 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.341 1.056 . . . . 0.0 112.225 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.49 ' H ' ' C ' ' A' ' 78' ' ' SER . . . -147.46 -178.78 6.43 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.944 1.298 . . . . 0.0 108.993 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.72 4.87 2.37 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -176.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.61 22.45 0.02 OUTLIER Glycine 0 CA--C 1.527 0.792 0 C-N-CA 120.27 -0.967 . . . . 0.0 114.279 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.4 t -146.93 -15.62 0.41 Allowed 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.668 1.234 . . . . 0.0 113.222 -177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -141.22 -39.6 0.4 Allowed 'General case' 0 N--CA 1.461 0.104 0 O-C-N 121.694 -0.629 . . . . 0.0 109.729 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.11 -27.18 67.86 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 173.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.73 -24.71 36.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 122.815 0.446 . . . . 0.0 110.668 177.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.88 -0.74 57.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -177.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.62 -23.78 2.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.475 0.579 . . . . 0.0 111.757 174.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.31 -1.62 24.51 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.011 0.524 . . . . 0.0 111.298 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -122.95 -11.59 8.09 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 122.972 0.509 . . . . 0.0 111.034 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.473 ' C ' ' H ' ' A' ' 93' ' ' ARG . 3.0 mm? -130.08 29.56 4.91 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.198 0.999 . . . . 0.0 110.325 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.97 10.39 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.655 1.182 . . . . 0.0 113.726 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.473 ' H ' ' C ' ' A' ' 91' ' ' LEU . 87.9 mmt-85 -130.08 0.18 4.69 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.413 0.685 . . . . 0.0 111.513 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.1 ttm -83.56 149.79 26.36 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.721 0.408 . . . . 0.0 110.432 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.1 m -63.52 138.97 97.51 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 123.722 0.809 . . . . 0.0 109.878 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.85 5.79 1.24 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.058 3.172 . . . . 0.0 113.364 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -121.3 -38.13 2.84 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.4 m -69.28 -24.23 63.93 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.835 -0.54 . . . . 0.0 109.955 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -70.73 -36.17 73.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.175 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -80.74 -24.1 38.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 118.613 0.642 . . . . 0.0 110.233 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.14 -33.91 76.47 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 173.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.5 tp -66.95 -41.17 87.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.6 mt -71.49 -5.09 30.5 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.527 0.331 . . . . 0.0 111.207 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 21.2 tp -111.81 -4.76 14.53 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.225 0.61 . . . . 0.0 112.216 -175.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -138.64 5.03 2.4 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -134.38 5.65 3.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.859 0.299 . . . . 0.0 111.518 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.3 mtm -136.91 2.43 2.6 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.637 0.775 . . . . 0.0 111.887 176.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -148.37 -19.64 0.33 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.566 0.621 . . . . 0.0 112.404 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 66.96 15.88 65.54 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-O 119.253 -0.749 . . . . 0.0 113.614 175.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -57.69 154.24 12.01 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.524 1.162 . . . . 0.0 111.453 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -63.31 146.35 96.27 Favored Pre-proline 0 N--CA 1.45 -0.448 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.554 175.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.37 -16.35 51.09 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 122.566 2.177 . . . . 0.0 111.364 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -73.99 -43.52 57.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.969 0.35 . . . . 0.0 110.268 178.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -78.09 -29.63 49.16 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.51 -28.82 67.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.913 -0.13 . . . . 0.0 110.812 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -74.32 -35.24 63.64 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -68.93 -26.26 64.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.659 0.384 . . . . 0.0 111.156 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -80.06 -9.07 59.67 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 18.4 pt -134.79 13.89 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 118.602 0.637 . . . . 0.0 111.371 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 58.97 53.07 5.84 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.683 1.193 . . . . 0.0 114.02 175.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.1 m -137.77 -175.69 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 C-N-CA 123.477 0.711 . . . . 0.0 110.057 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -91.88 162.31 14.48 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 175.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.1 m -58.62 -39.07 79.44 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 122.029 -0.419 . . . . 0.0 111.655 -177.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.8 p -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -74.58 -36.68 63.04 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 177.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.33 -38.05 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -61.79 -37.85 85.88 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.459 0.118 . . . . 0.0 111.001 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.5 m -75.45 -38.41 59.69 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 122.123 -0.36 . . . . 0.0 110.76 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -66.53 -31.97 73.03 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.389 -0.339 . . . . 0.0 111.727 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -82.19 -26.87 9.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 CA-C-N 118.689 0.677 . . . . 0.0 110.732 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 67.0 m -68.37 -35.85 78.33 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -78.22 -27.49 47.76 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.212 -0.305 . . . . 0.0 110.537 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.84 -42.52 70.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.278 -0.264 . . . . 0.0 110.666 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -75.58 -22.24 57.13 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.11 -0.369 . . . . 0.0 111.081 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.27 -36.64 69.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -73.72 -21.32 60.26 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 119.448 -0.311 . . . . 0.0 110.66 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 11.5 mm -74.14 -53.56 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.335 0.516 . . . . 0.0 109.665 174.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.95 -22.06 66.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.392 0.277 . . . . 0.0 111.634 -176.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -73.68 -24.89 60.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -157.64 -36.38 0.07 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -168.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 27.7 p . . . . . 0 N--CA 1.466 0.358 0 C-N-CA 124.798 1.239 . . . . 0.0 114.236 -171.884 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 120.442 0.163 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -63.88 -24.2 67.65 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.116 -0.365 . . . . 0.0 110.776 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -73.86 -34.06 56.68 Favored Glycine 0 C--N 1.337 0.612 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.03 -21.55 63.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.265 0.533 . . . . 0.0 110.743 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.45 -41.16 20.17 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.77 -42.11 58.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.448 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -66.28 -33.34 75.52 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.841 -178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.0 t -66.02 -42.66 89.34 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.475 0.58 . . . . 0.0 109.832 178.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -18.77 65.27 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -107.87 -12.47 15.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.082 -0.386 . . . . 0.0 111.571 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -69.18 -35.87 76.74 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -70.59 -23.13 62.52 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 57.9 m -70.92 -12.22 61.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.959 0.504 . . . . 0.0 111.435 175.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 38.5 pt -131.54 11.64 1.81 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.804 0.442 . . . . 0.0 111.641 -177.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -80.13 21.98 0.55 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.236 0.614 . . . . 0.0 110.553 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -137.7 -179.04 5.51 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.163 0.585 . . . . 0.0 111.107 -174.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -61.63 -179.9 0.21 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.066 0.946 . . . . 0.0 112.094 178.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.77 155.03 81.92 Favored Pre-proline 0 CA--C 1.528 0.113 0 C-N-CA 122.887 0.475 . . . . 0.0 110.016 -177.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -74.73 176.3 9.99 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.102 2.535 . . . . 0.0 110.78 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -146.46 -0.78 0.74 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.466 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -62.38 -24.38 67.34 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.004 0.521 . . . . 0.0 111.569 -179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 56.7 mtm -78.98 -37.11 40.2 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.577 0.351 . . . . 0.0 110.752 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -80.39 -17.02 53.09 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -69.02 -21.09 64.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.225 -0.297 . . . . 0.0 110.221 171.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -68.53 -20.56 64.57 Favored 'General case' 0 C--O 1.228 -0.052 0 O-C-N 122.024 -0.422 . . . . 0.0 110.03 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.469 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.6 mt -80.46 -21.38 42.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.214 173.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -75.18 10.92 1.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 172.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.469 ' H ' ' C ' ' B' ' 52' ' ' LEU . 37.6 ttpt -120.08 -1.27 10.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.822 1.249 . . . . 0.0 110.112 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -149.43 -13.91 0.29 Allowed 'General case' 0 C--N 1.34 0.184 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.279 0 C-N-CA 123.293 0.637 . . . . 0.0 111.908 179.684 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.7 p . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -63.64 -12.43 33.68 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.57 -27.97 61.88 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -75.3 1.0 14.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.699 0.8 . . . . 0.0 111.193 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -132.27 -1.85 3.57 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.591 0.756 . . . . 0.0 111.262 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 44.7 mt -111.81 -31.53 6.92 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.585 0.354 . . . . 0.0 111.052 176.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.39 -44.41 13.07 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.73 -3.86 14.28 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.253 1.969 . . . . 0.0 112.834 -175.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -135.47 14.58 3.45 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 122.949 0.5 . . . . 0.0 110.643 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 16.4 tp -56.0 -39.74 79.66 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -174.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.39 -4.47 13.7 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.083 1.855 . . . . 0.0 112.667 -178.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -65.51 -23.29 66.85 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.665 0.666 . . . . 0.0 111.733 -176.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mp -74.49 -18.8 60.57 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.561 -0.712 . . . . 0.0 110.309 176.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -99.58 -27.92 13.46 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.589 0.356 . . . . 0.0 111.168 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -61.39 -15.67 38.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -140.41 -16.8 0.92 Allowed 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 174.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.46 -26.34 74.3 Favored Glycine 0 C--N 1.338 0.661 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -66.45 -37.63 85.58 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.014 0.907 . . . . 0.0 110.497 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.76 -16.07 54.79 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.529 0.331 . . . . 0.0 111.332 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.4 tp -79.53 -2.21 41.2 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.897 0.479 . . . . 0.0 111.952 -177.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.8 t -147.86 -16.78 0.36 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.907 -0.496 . . . . 0.0 112.333 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.33 11.55 85.4 Favored Glycine 0 CA--C 1.527 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 113.138 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.9 m -142.8 123.26 13.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.141 0.97 . . . . 0.0 110.12 -178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -66.73 -24.1 66.19 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.762 -177.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -68.72 -39.13 80.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.1 0.409 . . . . 0.0 110.891 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -82.36 -31.79 29.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.74 -43.72 95.85 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.57 -33.67 73.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.428 0.614 . . . . 0.0 110.546 178.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.3 -45.63 75.96 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 122.543 0.337 . . . . 0.0 110.968 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -64.13 -34.41 77.99 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.035 0.38 . . . . 0.0 111.032 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.36 -55.07 26.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 117.812 0.278 . . . . 0.0 111.116 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.1 ttp180 -75.51 -27.12 58.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.01 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.02 -26.74 64.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 117.499 0.136 . . . . 0.0 110.758 176.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.8 m -65.87 -38.09 87.88 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.7 -43.19 59.97 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -61.98 -18.57 60.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.848 0.459 . . . . 0.0 110.96 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -86.77 0.3 55.01 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.077 0.551 . . . . 0.0 112.078 177.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 77.6 mt -120.68 -20.9 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 122.724 0.41 . . . . 0.0 111.407 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.9 m -65.88 -4.5 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 118.832 0.742 . . . . 0.0 112.326 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.12 3.64 7.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.647 0.779 . . . . 0.0 110.31 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.0 56.29 1.26 Allowed Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.648 0.779 . . . . 0.0 110.303 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -64.99 -10.96 27.52 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.005 2.47 . . . . 0.0 111.782 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.26 -16.46 62.48 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.968 -0.457 . . . . 0.0 110.479 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -84.5 3.07 38.11 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.005 0.522 . . . . 0.0 110.909 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -129.36 68.17 79.81 Favored Pre-proline 0 N--CA 1.454 -0.244 0 C-N-CA 122.408 0.283 . . . . 0.0 110.783 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.03 167.71 24.01 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.827 3.018 . . . . 0.0 110.746 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.2 11.28 11.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.82 7.55 3.05 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.072 0.949 . . . . 0.0 111.558 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 32.6 m -134.92 177.41 6.87 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.777 0.831 . . . . 0.0 109.911 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.439 ' C ' ' H ' ' A' ' 53' ' ' ARG . 9.7 m-20 -59.32 151.23 59.99 Favored Pre-proline 0 N--CA 1.455 -0.22 0 C-N-CA 122.43 0.292 . . . . 0.0 110.291 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -70.64 12.71 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.063 3.176 . . . . 0.0 111.629 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 51' ' ' ASP . 98.6 mtt180 -133.52 -17.61 2.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.438 0.695 . . . . 0.0 111.734 178.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 41.8 tp -74.45 -31.65 62.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.565 0.621 . . . . 0.0 110.198 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.91 -26.41 64.71 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -67.34 -42.17 83.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -79.87 -32.58 40.41 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.562 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -63.72 -44.81 92.51 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.632 0.651 . . . . 0.0 111.448 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.3 mmm -76.73 -33.4 58.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.01 -176.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -69.88 -33.31 72.07 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.477 177.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -67.53 -29.02 68.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.29 -37.98 71.19 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 49.5 mm -72.21 -38.25 61.71 Favored 'Isoleucine or valine' 0 C--O 1.23 0.074 0 CA-C-N 117.692 0.746 . . . . 0.0 110.267 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -69.52 -33.76 73.28 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.264 -0.272 . . . . 0.0 110.554 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.05 -33.11 73.06 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.106 -0.371 . . . . 0.0 110.262 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.2 t -73.06 -25.71 61.02 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.15 -36.5 61.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.169 0.187 . . . . 0.0 110.594 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -75.64 -23.86 56.38 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.3 -0.25 . . . . 0.0 110.452 176.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -72.6 2.14 6.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.262 0.625 . . . . 0.0 111.869 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -140.11 3.85 2.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.038 0.535 . . . . 0.0 111.001 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 72.19 13.95 76.57 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.82 -0.433 . . . . 0.0 112.524 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -69.14 -6.11 26.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 117.675 0.737 . . . . 0.0 111.454 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.28 159.83 43.2 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.062 -0.399 . . . . 0.0 110.69 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -148.69 -166.67 2.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.973 1.309 . . . . 0.0 108.76 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -57.63 173.23 0.3 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.116 0.566 . . . . 0.0 110.617 174.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.6 p -138.14 171.54 14.25 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.26 0.552 . . . . 0.0 111.996 -173.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -145.5 16.72 1.48 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.713 0.805 . . . . 0.0 110.67 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m 61.77 179.06 0.12 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.465 1.106 . . . . 0.0 112.642 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -141.39 25.78 2.02 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.882 0.473 . . . . 0.0 111.394 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.64 -173.63 2.79 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.714 0.806 . . . . 0.0 109.928 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.8 8.0 3.26 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -173.27 10.29 0.04 OUTLIER Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.643 -0.789 . . . . 0.0 114.446 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.6 t -148.38 9.09 0.83 Allowed 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.52 1.16 . . . . 0.0 112.269 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -154.02 -41.79 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.988 -0.445 . . . . 0.0 109.99 174.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.19 -23.09 64.8 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 121.65 -0.656 . . . . 0.0 109.808 174.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.43 -26.1 38.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 122.446 0.299 . . . . 0.0 110.364 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.64 -3.76 54.33 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.184 0.594 . . . . 0.0 111.845 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -129.75 -13.07 4.24 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.07 -1.92 31.47 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.098 0.559 . . . . 0.0 110.794 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -126.49 -15.62 5.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.489 0.716 . . . . 0.0 110.594 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -135.96 38.89 2.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.782 1.233 . . . . 0.0 110.204 -176.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.33 2.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -130.42 7.81 4.97 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.916 0.78 . . . . 0.0 112.333 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 tpp -61.86 142.78 57.16 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.014 0.37 . . . . 0.0 110.034 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 m -64.07 137.88 97.24 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.091 0.556 . . . . 0.0 109.665 178.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -68.81 5.5 1.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.905 3.07 . . . . 0.0 113.394 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -127.54 -33.67 2.3 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.5 m -67.84 -24.16 65.24 Favored 'General case' 0 C--N 1.337 0.057 0 O-C-N 121.858 -0.526 . . . . 0.0 109.951 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttm-85 -67.09 -32.52 73.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.671 0.388 . . . . 0.0 110.195 174.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -74.51 -37.48 63.09 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.34 -34.07 75.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 122.184 -0.322 . . . . 0.0 110.285 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.2 tp -65.96 -42.59 89.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.676 0.39 . . . . 0.0 110.947 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.13 -6.68 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.712 -0.617 . . . . 0.0 111.347 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -97.94 -4.9 35.45 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 175.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 69.4 p -134.84 3.37 3.22 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -140.16 10.43 2.35 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.246 0.475 . . . . 0.0 112.084 177.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.407 ' SD ' ' HB3' ' B' ' 32' ' ' LEU . 2.4 mtm -137.49 -8.9 1.69 Allowed 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -150.27 -9.01 0.28 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.012 0.824 . . . . 0.0 112.683 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 69.51 23.07 76.71 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.084 -0.842 . . . . 0.0 113.738 173.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -56.19 150.83 13.5 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.709 1.254 . . . . 0.0 109.98 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.4 m -66.07 155.61 86.75 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.3 -19.62 43.72 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 122.382 2.055 . . . . 0.0 111.357 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -73.57 -33.49 64.68 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.997 -0.439 . . . . 0.0 110.224 176.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -83.4 -37.91 22.65 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.31 0.244 . . . . 0.0 110.434 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.11 -27.4 68.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.213 -0.304 . . . . 0.0 111.03 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.16 -32.07 33.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 117.688 0.222 . . . . 0.0 110.721 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -71.4 -30.55 66.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.134 0.574 . . . . 0.0 110.836 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 58.6 mt -74.14 -5.77 43.72 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 176.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.0 pt -135.38 11.57 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 118.725 0.693 . . . . 0.0 111.289 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 55.06 54.55 8.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.516 1.126 . . . . 0.0 114.016 176.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.9 m -136.06 176.07 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.111 0.564 . . . . 0.0 110.266 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -74.38 157.3 35.93 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 88.4 m -60.97 -36.23 78.86 Favored 'General case' 0 N--CA 1.457 -0.106 0 O-C-N 122.193 -0.317 . . . . 0.0 110.81 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 95.6 p -75.94 -21.17 57.32 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.063 -0.398 . . . . 0.0 111.134 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -74.67 -43.29 55.98 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.087 -0.383 . . . . 0.0 110.413 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.63 -31.5 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 C-N-CA 119.481 -0.888 . . . . 0.0 110.063 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -63.67 -34.11 77.12 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.8 m -77.13 -37.59 53.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.222 -0.299 . . . . 0.0 110.422 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.03 -33.79 76.88 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.383 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.12 -26.86 9.21 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 118.314 0.506 . . . . 0.0 111.096 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.5 m -67.59 -38.5 84.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -78.34 -25.2 46.34 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 122.263 -0.273 . . . . 0.0 110.5 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.72 48.61 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.744 0.247 . . . . 0.0 110.342 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.79 -22.21 63.34 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.084 -0.385 . . . . 0.0 110.968 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.1 -36.41 69.45 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.387 -0.196 . . . . 0.0 110.967 176.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -83.79 -16.8 43.31 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.759 -0.588 . . . . 0.0 111.094 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 9.4 mm -62.24 -52.63 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.53 -17.31 60.76 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.88 -15.6 63.1 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -147.47 -44.4 0.17 Allowed 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 47.6 p . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 118.759 2.874 . . . . 0.0 118.759 -177.204 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 . . . . . 0 CA--C 1.53 0.173 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.6 tpt -63.08 -25.76 68.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.908 0.322 . . . . 0.0 111.46 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.02 58.72 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.71 -16.04 62.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.238 -0.566 . . . . 0.0 111.014 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.12 -39.24 18.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.407 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 63.2 mt -74.43 -38.07 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.937 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -68.26 -33.69 74.83 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.175 -0.44 . . . . 0.0 110.471 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.5 t -66.24 -36.5 83.17 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.665 0.666 . . . . 0.0 110.622 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.65 -32.09 73.47 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.584 0.231 . . . . 0.0 111.014 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -97.96 -11.38 23.14 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 68.7 tp60 -71.36 -36.68 71.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 121.899 -0.501 . . . . 0.0 110.196 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -64.63 -24.35 67.56 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 120.311 -0.555 . . . . 0.0 110.835 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 13.1 m -70.17 -12.62 61.73 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 111.382 0.141 . . . . 0.0 111.382 174.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 67.6 mt -107.16 -18.05 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 O-C-N 121.96 -0.463 . . . . 0.0 110.785 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.51 26.64 0.1 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.575 0.75 . . . . 0.0 112.054 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -142.06 176.5 8.91 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.058 0.543 . . . . 0.0 111.151 -178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -63.35 175.31 1.01 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.865 0.866 . . . . 0.0 111.362 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.94 155.12 80.51 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 122.407 0.283 . . . . 0.0 110.481 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . 0.499 ' C ' ' H ' ' B' ' 47' ' ' GLU . 51.5 Cg_exo -54.79 -39.55 89.15 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.681 2.921 . . . . 0.0 114.952 -174.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.8 t70 51.37 -11.18 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.473 1.909 . . . . 0.0 115.286 -174.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.499 ' H ' ' C ' ' B' ' 45' ' ' PRO . 14.1 pt-20 -66.53 -16.51 64.2 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.131 -0.981 . . . . 0.0 111.65 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 29.6 mtm -73.3 -32.25 64.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.274 -0.266 . . . . 0.0 111.044 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -84.24 -12.27 55.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.793 -0.567 . . . . 0.0 110.018 173.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.21 -20.61 62.24 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.837 -0.539 . . . . 0.0 109.649 169.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 75.9 mt -78.55 -13.58 59.76 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.337 0.255 . . . . 0.0 110.406 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -88.13 -16.0 34.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -75.55 6.85 4.22 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.845 0.858 . . . . 0.0 111.675 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -127.66 9.77 6.53 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.732 0.813 . . . . 0.0 111.566 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 pp -145.21 -17.33 0.49 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 120.807 0.337 . . . . 0.0 110.78 173.631 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.9 t . . . . . 0 N--CA 1.456 -0.142 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.3 tp -59.22 -28.57 66.8 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.038 0.535 . . . . 0.0 110.967 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.45 -31.5 80.97 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.938 -0.465 . . . . 0.0 111.938 -178.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -77.17 1.42 18.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 122.719 0.408 . . . . 0.0 111.265 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -133.07 3.57 3.71 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.189 0.595 . . . . 0.0 110.695 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.6 tp -111.69 -41.1 4.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.542 0.337 . . . . 0.0 110.45 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.16 -45.23 99.88 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.86 -0.39 9.84 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.431 2.087 . . . . 0.0 112.774 -176.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -135.13 14.04 3.55 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 68.3 mt -54.33 -44.31 98.57 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.574 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -81.47 -10.01 12.25 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.07 1.847 . . . . 0.0 112.672 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.57 -24.52 66.36 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 118.646 0.657 . . . . 0.0 110.621 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.2 mt -67.4 -18.92 65.31 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.67 0.271 . . . . 0.0 110.442 176.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -98.81 -14.65 19.58 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.462 0.705 . . . . 0.0 110.276 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -16.24 53.78 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.438 0.695 . . . . 0.0 111.097 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -141.59 -21.02 0.74 Allowed 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.52 -23.24 77.76 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -71.87 -10.02 59.16 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 117.657 0.729 . . . . 0.0 111.647 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.08 6.1 5.39 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.74 0.416 . . . . 0.0 111.466 -177.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -91.95 -0.96 57.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.098 0.559 . . . . 0.0 110.437 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 t -151.37 -4.95 0.28 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.44 18.08 71.28 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.44 -0.788 . . . . 0.0 114.096 173.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 t -143.81 131.24 21.0 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 118.344 1.072 . . . . 0.0 110.16 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -74.67 -22.94 58.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.181 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.57 -35.53 58.13 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -73.88 -35.77 64.74 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.0 -36.57 86.38 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.64 -35.69 75.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.222 0.511 . . . . 0.0 111.323 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.8 24.07 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.753 -176.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -65.18 -35.98 82.79 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.295 0.952 . . . . 0.0 109.427 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 24.6 t -62.91 -53.52 45.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 C-N-CA 122.338 0.255 . . . . 0.0 110.687 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -71.58 -28.12 63.61 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.43 -175.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.02 -21.59 59.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 122.201 0.2 . . . . 0.0 110.748 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 m -66.37 -44.88 81.92 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -38.1 64.2 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.964 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -67.32 -14.56 63.03 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.803 -0.561 . . . . 0.0 110.923 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.4 0.4 56.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.324 0.65 . . . . 0.0 111.216 174.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 88.3 mt -123.57 -14.27 5.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 123.523 0.729 . . . . 0.0 111.358 -174.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -60.07 -4.79 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 121.503 -0.748 . . . . 0.0 112.964 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.3 2.1 8.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.024 0.53 . . . . 0.0 111.143 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.32 54.74 0.86 Allowed Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 123.651 0.781 . . . . 0.0 110.544 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.7 -13.04 36.83 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 123.435 2.757 . . . . 0.0 113.049 -174.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -74.99 -14.97 60.68 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.463 0.305 . . . . 0.0 111.213 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -77.74 -19.79 54.56 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.007 -0.433 . . . . 0.0 111.016 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.46 114.55 52.33 Favored Pre-proline 0 N--CA 1.452 -0.345 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.87 155.09 71.12 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.526 2.151 . . . . 0.0 110.986 -176.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -136.8 12.85 3.15 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.771 0.828 . . . . 0.0 110.772 -174.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -134.73 27.93 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.343 0.657 . . . . 0.0 111.041 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.6 m -134.76 179.15 4.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 123.828 0.851 . . . . 0.0 109.207 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -54.43 146.72 31.79 Favored Pre-proline 0 CA--C 1.531 0.212 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -70.79 9.71 0.73 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.826 3.017 . . . . 0.0 111.722 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -129.37 -16.88 3.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.5 0.72 . . . . 0.0 110.933 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.8 tp -78.84 -34.17 45.37 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.165 0.439 . . . . 0.0 110.303 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.64 -31.28 60.79 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.54 -47.67 77.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -74.75 -30.0 61.34 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 119.698 -0.191 . . . . 0.0 111.485 -177.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -63.05 -45.91 89.99 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 118.382 0.537 . . . . 0.0 110.605 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 92.9 mmm -73.54 -31.3 63.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.829 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.37 -37.9 74.65 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.036 0.38 . . . . 0.0 111.016 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -65.71 -24.82 67.07 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.29 -37.22 63.24 Favored Glycine 0 C--N 1.339 0.721 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.5 mm -73.19 -39.93 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 CA-C-N 117.709 0.755 . . . . 0.0 110.432 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -68.27 -33.64 74.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.293 -0.254 . . . . 0.0 111.122 -177.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.32 -31.54 68.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 117.78 0.264 . . . . 0.0 110.433 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.2 t -75.97 -26.1 56.46 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.146 0.178 . . . . 0.0 110.835 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.58 -36.79 68.26 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.382 0.273 . . . . 0.0 110.991 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -77.15 -22.81 52.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.55 3.64 18.21 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.259 0.624 . . . . 0.0 111.747 177.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -138.86 2.91 2.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.846 0.458 . . . . 0.0 111.242 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.43 26.62 72.95 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 119.684 -0.509 . . . . 0.0 113.133 175.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.63 -10.15 17.3 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.164 0.982 . . . . 0.0 112.249 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.65 158.5 38.42 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.057 0.543 . . . . 0.0 110.363 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -144.52 5.73 1.23 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.344 0.657 . . . . 0.0 110.769 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.0 t -156.69 178.09 10.73 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.071 0.548 . . . . 0.0 109.956 -177.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.5 p -145.43 17.24 1.51 Allowed 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.528 0.731 . . . . 0.0 110.619 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -56.42 150.32 15.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.11 0.564 . . . . 0.0 110.278 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -144.84 -176.27 5.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.22 0.608 . . . . 0.0 109.855 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -141.21 13.12 2.2 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.782 0.433 . . . . 0.0 111.697 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.82 156.92 13.2 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.062 -0.398 . . . . 0.0 110.835 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.42 -11.94 59.91 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -175.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 156.19 26.04 0.03 OUTLIER Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.305 -0.719 . . . . 0.0 113.787 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.7 t -138.05 13.48 2.86 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.602 1.201 . . . . 0.0 112.111 -177.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -155.16 -50.04 0.09 Allowed 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -20.75 64.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.477 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.56 -29.96 47.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 122.465 0.306 . . . . 0.0 110.828 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.23 -2.05 54.63 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.822 0.449 . . . . 0.0 111.564 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -116.04 -44.62 2.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.58 0.352 . . . . 0.0 110.776 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.7 -1.61 1.99 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 82.6 mtt-85 -120.82 -15.38 8.36 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.424 0.69 . . . . 0.0 111.516 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -134.32 28.23 3.73 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.909 0.884 . . . . 0.0 110.626 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.88 1.07 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -130.85 0.29 4.29 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.641 0.655 . . . . 0.0 112.097 -175.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.7 ttm -59.14 152.02 21.35 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.6 m -53.46 137.76 50.69 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 123.172 0.589 . . . . 0.0 110.548 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.95 -5.43 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 125.083 3.855 . . . . 0.0 115.9 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 21.7 tp -133.57 -23.49 1.84 Allowed 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 111.898 -178.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 48.2 m -68.74 -24.7 64.49 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.639 0.654 . . . . 0.0 109.878 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 69.3 ttt-85 -73.07 -27.78 61.93 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -78.27 -35.24 48.35 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.84 74.59 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.3 tp -65.76 -49.78 67.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.395 0.278 . . . . 0.0 110.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.26 -4.55 33.81 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.1 tp -106.15 -4.59 20.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.09 0.556 . . . . 0.0 111.72 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 77.3 p -140.06 3.28 1.98 Allowed 'General case' 0 C--N 1.34 0.189 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.52 6.2 4.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.324 0.511 . . . . 0.0 112.147 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 1.4 mtm -127.38 -7.7 5.81 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.927 0.491 . . . . 0.0 111.887 176.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -150.65 -22.9 0.23 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.744 0.702 . . . . 0.0 112.103 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 79.05 28.05 54.87 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.218 -0.768 . . . . 0.0 113.426 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -51.25 149.22 4.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.275 1.037 . . . . 0.0 110.659 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.0 m -62.16 152.54 77.99 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.78 -17.02 37.73 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.996 2.464 . . . . 0.0 111.945 -176.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -78.98 -41.34 29.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.029 0.377 . . . . 0.0 110.368 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -78.7 -30.51 46.05 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.49 -25.36 64.93 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 175.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.05 -27.75 35.61 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.125 0.17 . . . . 0.0 110.757 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -70.45 -33.42 71.27 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.036 0.535 . . . . 0.0 111.628 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 77.7 mt -74.02 -4.29 34.46 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 28.6 pt -135.92 9.22 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 118.306 0.503 . . . . 0.0 110.978 177.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 50.08 61.04 3.39 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.136 1.374 . . . . 0.0 113.935 178.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 22.3 m -134.69 -175.51 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 C-N-CA 123.854 0.862 . . . . 0.0 109.792 175.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -89.65 159.66 17.02 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -56.51 -39.11 72.75 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 122.565 0.346 . . . . 0.0 111.416 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.2 m -70.82 -20.57 62.55 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.868 0.467 . . . . 0.0 112.034 -177.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -73.98 -40.7 62.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.5 t -63.45 -38.22 81.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.12 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -60.56 -38.44 84.55 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.48 0.181 . . . . 0.0 110.856 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.3 m -76.12 -37.71 57.75 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.905 -0.134 . . . . 0.0 110.772 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.82 -34.09 77.04 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.415 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 m -81.34 -28.44 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 CA-C-N 118.452 0.569 . . . . 0.0 111.028 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 55.4 m -66.22 -40.52 90.36 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.49 -28.16 56.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.4 -44.11 65.56 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.344 -0.222 . . . . 0.0 111.246 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.61 -22.83 59.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 O-C-N 122.15 -0.344 . . . . 0.0 111.026 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.17 -42.63 72.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.611 0.187 . . . . 0.0 110.935 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -77.75 -17.8 57.17 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.151 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.5 mm -73.94 -53.93 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 173.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.43 -17.12 63.62 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -173.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -85.69 -10.84 55.06 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -156.69 -36.35 0.08 Allowed 'General case' 0 C--N 1.339 0.145 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 43.0 p . . . . . 0 N--CA 1.468 0.463 0 C-N-CA 124.341 1.056 . . . . 0.0 112.852 -169.728 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 111.013 0.005 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.61 -26.91 62.23 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.098 0.559 . . . . 0.0 112.269 -175.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.93 -42.52 96.84 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.32 -20.44 62.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 122.507 -0.408 . . . . 0.0 110.772 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.59 -36.53 70.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.74 -37.43 67.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -66.48 -32.63 74.11 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.563 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 57.8 m -66.6 -42.11 87.44 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.651 0.659 . . . . 0.0 110.74 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -24.5 64.95 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -107.73 -13.63 14.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -175.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -68.66 -31.26 70.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 170.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -57.5 -37.07 72.37 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 175.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.4 m -68.41 -12.58 61.36 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.416 ' C ' ' H ' ' B' ' 42' ' ' GLU . 46.6 mm -105.9 -16.02 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.803 -0.561 . . . . 0.0 111.259 -178.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.92 28.62 0.17 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.252 0.621 . . . . 0.0 110.646 175.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' B' ' 40' ' ' ILE . 81.4 mm-40 -134.32 173.66 11.38 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.225 0.61 . . . . 0.0 111.309 -174.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -69.12 179.01 2.05 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.023 0.929 . . . . 0.0 110.89 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.4 m -136.82 155.01 76.73 Favored Pre-proline 0 C--O 1.233 0.234 0 C-N-CA 123.376 0.67 . . . . 0.0 110.41 -178.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -77.25 178.74 7.26 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.691 2.927 . . . . 0.0 110.531 176.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -145.99 -0.44 0.8 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.985 0.514 . . . . 0.0 110.929 175.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.15 -24.64 67.46 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 122.912 0.485 . . . . 0.0 112.242 -177.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 53.4 mtm -74.81 -32.78 62.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 122.225 -0.297 . . . . 0.0 110.788 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.71 -12.65 55.56 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.28 -20.44 61.51 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 69.9 mt -71.0 -18.35 62.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.181 -0.324 . . . . 0.0 110.337 172.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 18.5 mt -84.94 -19.15 32.63 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.728 173.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -73.14 8.19 1.76 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.932 0.333 . . . . 0.0 111.039 176.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -130.37 12.96 5.54 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.813 0.845 . . . . 0.0 109.986 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.1 mt -131.47 -26.36 2.06 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 123.568 0.747 . . . . 0.0 111.784 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.274 0 CA-C-N 118.016 0.371 . . . . 0.0 110.511 171.17 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.8 p . . . . . 0 CA--C 1.531 0.213 0 CA-C-O 120.805 0.336 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.2 tp -56.72 -33.36 66.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.669 0.788 . . . . 0.0 111.901 -178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.61 -35.08 91.5 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 121.69 -0.631 . . . . 0.0 112.051 -176.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -74.33 3.17 7.77 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.747 0.819 . . . . 0.0 110.94 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.3 mm-40 -131.81 -1.93 3.74 Favored 'General case' 0 N--CA 1.458 -0.059 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 tt -111.37 -43.05 3.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.125 0.57 . . . . 0.0 110.624 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.57 -45.2 99.53 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -75.04 2.26 6.85 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.264 1.976 . . . . 0.0 113.16 -176.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -130.85 9.92 5.0 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.777 0.431 . . . . 0.0 112.02 -177.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -56.6 -42.35 95.83 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.81 -7.53 14.48 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.922 1.748 . . . . 0.0 112.58 -173.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -71.61 -19.86 62.06 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.542 0.61 . . . . 0.0 111.945 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.8 mp -77.18 -23.36 51.54 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.815 -0.553 . . . . 0.0 110.886 -178.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -101.78 -15.56 16.9 Favored 'General case' 0 C--O 1.228 -0.027 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -52.48 -27.66 17.15 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.711 1.205 . . . . 0.0 110.884 175.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -137.42 -13.54 1.54 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.568 0.347 . . . . 0.0 111.241 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.44 -34.95 87.51 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 47.2 tpt85 -65.44 -20.88 66.55 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.1 0.95 . . . . 0.0 111.369 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.92 -3.6 55.76 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.824 0.45 . . . . 0.0 110.906 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mp -111.56 7.77 20.72 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.956 0.902 . . . . 0.0 111.141 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.1 p -140.46 -22.43 0.82 Allowed 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.43 8.73 60.04 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-O 119.558 -0.579 . . . . 0.0 112.673 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.5 t -154.51 138.12 16.04 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.331 1.065 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -72.5 -23.19 60.99 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.438 -0.164 . . . . 0.0 110.821 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -70.33 -39.06 74.96 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.314 -0.241 . . . . 0.0 110.562 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -82.2 -32.07 30.04 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.07 -43.55 90.27 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -72.5 -29.4 63.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 117.341 0.57 . . . . 0.0 110.817 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 tmmm? -70.7 -44.04 67.77 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.882 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -64.67 -31.9 73.33 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.129 0.422 . . . . 0.0 110.91 179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.4 t -62.08 -52.75 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 117.995 0.361 . . . . 0.0 110.935 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -76.59 -26.77 55.38 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.358 -176.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.38 -24.98 61.34 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.284 0.234 . . . . 0.0 110.503 176.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 66.3 m -65.98 -40.15 90.96 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 175.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 -46.64 65.6 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -59.62 -25.32 64.56 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.902 0.481 . . . . 0.0 111.695 -178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.88 1.0 32.69 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.132 0.573 . . . . 0.0 111.617 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.4 mt -123.8 -16.01 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 123.766 0.826 . . . . 0.0 110.561 -176.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.5 t -59.59 -13.92 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.181 0.592 . . . . 0.0 111.641 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 3.74 9.67 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.063 0.545 . . . . 0.0 111.298 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.31 55.73 1.23 Allowed Pre-proline 0 N--CA 1.452 -0.346 0 C-N-CA 122.935 0.494 . . . . 0.0 110.608 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.45 -8.84 20.21 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.109 2.54 . . . . 0.0 112.173 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -78.7 -6.66 56.38 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.903 0.481 . . . . 0.0 110.791 174.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -99.49 8.51 44.46 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.511 0.725 . . . . 0.0 110.774 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -134.23 62.06 53.98 Favored Pre-proline 0 CA--C 1.533 0.317 0 C-N-CA 123.064 0.546 . . . . 0.0 109.976 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.78 163.69 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.701 3.601 . . . . 0.0 114.849 -175.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.41 8.99 10.24 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.49 1.116 . . . . 0.0 109.506 177.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -76.08 5.25 6.98 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.168 0.987 . . . . 0.0 111.891 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.3 m -136.68 -179.2 2.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.991 0.916 . . . . 0.0 109.347 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.533 ' C ' ' H ' ' A' ' 53' ' ' ARG . 1.8 m-20 -54.46 147.03 30.69 Favored Pre-proline 0 N--CA 1.455 -0.219 0 O-C-N 122.388 -0.195 . . . . 0.0 110.546 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -71.44 18.54 0.27 Allowed 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 124.148 3.232 . . . . 0.0 110.528 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.533 ' H ' ' C ' ' A' ' 51' ' ' ASP . 86.6 mtm180 -131.51 -30.38 1.68 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.001 0.92 . . . . 0.0 110.99 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 62.1 tp -72.01 -39.42 69.22 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.682 0.219 . . . . 0.0 110.588 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.68 -29.83 62.84 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.68 -40.9 97.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.63 0.372 . . . . 0.0 110.075 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.54 -27.67 41.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -68.56 -41.45 79.73 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.358 -0.214 . . . . 0.0 110.838 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 98.4 mmm -81.71 -31.24 32.2 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.796 -0.145 . . . . 0.0 110.888 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.4 -37.39 83.04 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -71.87 -24.26 61.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.54 -37.69 93.94 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.8 mm -73.78 -35.47 43.49 Favored 'Isoleucine or valine' 0 C--N 1.338 0.104 0 CA-C-N 117.892 0.846 . . . . 0.0 109.882 176.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -65.9 -37.41 86.03 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.92 -30.27 67.64 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.305 -0.247 . . . . 0.0 110.832 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.3 t -74.89 -28.83 60.79 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 110.618 -0.141 . . . . 0.0 110.618 178.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.54 -31.11 65.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.097 -0.377 . . . . 0.0 110.709 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -83.01 -12.55 57.16 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.539 0.336 . . . . 0.0 110.705 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.9 5.84 49.91 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.351 0.66 . . . . 0.0 111.124 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -137.53 0.48 2.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.005 0.522 . . . . 0.0 111.133 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.67 6.21 89.11 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.732 -0.482 . . . . 0.0 113.323 176.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -66.49 -20.0 65.93 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.985 0.892 . . . . 0.0 110.621 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.99 153.11 29.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.818 0.847 . . . . 0.0 109.688 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -147.61 -0.59 0.64 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.735 0.414 . . . . 0.0 111.958 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.5 t -160.61 175.47 12.64 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.155 0.434 . . . . 0.0 110.436 -177.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.4 p -153.0 159.82 42.95 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.489 0.715 . . . . 0.0 110.121 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -160.91 177.03 10.78 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.277 0.631 . . . . 0.0 109.482 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.0 m -141.64 155.43 45.71 Favored 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 123.296 0.638 . . . . 0.0 109.314 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -152.09 14.04 0.61 Allowed 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -173.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.56 165.97 2.66 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.057 0.456 . . . . 0.0 111.223 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.37 -10.88 55.46 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.52 21.23 0.03 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.949 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.7 t -137.11 6.44 2.85 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.715 1.257 . . . . 0.0 112.742 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -143.92 -36.01 0.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.02 -25.63 66.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.6 -24.56 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 122.567 0.347 . . . . 0.0 110.517 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.06 -1.4 56.79 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.859 0.463 . . . . 0.0 111.814 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -130.41 -16.07 3.53 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 117.804 0.275 . . . . 0.0 111.625 175.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.07 -1.54 32.89 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.771 0.259 . . . . 0.0 110.566 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -130.55 -8.54 4.11 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.585 0.754 . . . . 0.0 112.034 -177.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.8 mt -139.58 12.9 2.53 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -170.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.54 5.45 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -130.29 3.73 4.73 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 119.12 0.873 . . . . 0.0 112.642 -173.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 52.9 ttm -67.09 158.99 29.77 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 98.0 m -59.01 138.08 87.71 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 122.89 0.476 . . . . 0.0 109.944 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.0 -7.87 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 125.19 3.927 . . . . 0.0 116.335 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.1 tp -131.73 -22.29 2.4 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 119.002 0.819 . . . . 0.0 111.814 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.4 m -66.99 -19.18 65.67 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.929 -0.482 . . . . 0.0 110.059 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -65.87 -34.13 77.43 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.649 0.38 . . . . 0.0 110.25 175.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -80.7 -34.69 34.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.27 -32.38 74.01 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.966 -0.459 . . . . 0.0 109.794 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.71 -46.14 73.08 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.004 0.522 . . . . 0.0 110.78 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -74.94 -6.65 50.37 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.353 0.524 . . . . 0.0 111.445 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 74.9 mt -99.79 -6.29 27.19 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.767 0.427 . . . . 0.0 112.0 176.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -135.08 4.72 3.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.488 0.585 . . . . 0.0 112.551 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.96 7.93 1.86 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.49 0.316 . . . . 0.0 111.383 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.1 mtm -141.98 1.83 1.49 Allowed 'General case' 0 C--N 1.338 0.087 0 C-N-CA 123.487 0.715 . . . . 0.0 111.87 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -149.43 -17.93 0.28 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.628 0.649 . . . . 0.0 112.187 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 72.51 10.85 76.15 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 119.282 -0.732 . . . . 0.0 113.401 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -59.73 148.21 35.02 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.819 1.309 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.2 m -70.06 152.51 95.8 Favored Pre-proline 0 N--CA 1.452 -0.333 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.29 -24.08 25.75 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.208 2.605 . . . . 0.0 113.206 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.05 -34.6 66.39 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.611 0.364 . . . . 0.0 111.343 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -79.68 -38.28 33.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.87 -24.68 65.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.729 -0.177 . . . . 0.0 111.124 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.4 -39.11 65.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.958 0.345 . . . . 0.0 110.507 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -67.38 -26.11 66.3 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.597 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 18.4 tp -83.47 -6.2 59.39 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -176.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 15.7 pt -135.46 11.99 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.645 0.657 . . . . 0.0 111.435 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 56.81 53.71 7.95 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.186 0.994 . . . . 0.0 113.524 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 28.2 m -136.38 178.61 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 123.443 0.697 . . . . 0.0 110.058 176.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -80.44 157.67 26.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 46.5 m -60.35 -34.4 73.79 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.9 -0.5 . . . . 0.0 110.818 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 84.0 p -72.28 -21.36 61.37 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 122.377 -0.202 . . . . 0.0 111.46 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -74.39 -36.36 63.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.2 t -64.05 -37.69 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.71 -33.23 73.65 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.2 m -77.31 -38.28 50.89 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 122.341 -0.224 . . . . 0.0 110.795 177.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.2 -35.61 80.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.128 0.422 . . . . 0.0 111.429 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.5 m -76.42 -27.65 17.54 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 118.805 0.73 . . . . 0.0 110.716 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.3 m -67.43 -35.76 79.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -81.15 -25.06 37.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.77 -47.34 66.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.51 -22.43 61.79 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.818 -0.135 . . . . 0.0 110.966 179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.51 -36.7 68.42 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -72.85 -25.11 60.99 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 117.668 0.213 . . . . 0.0 110.605 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 20.2 mm -72.83 -54.62 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -61.54 -21.68 64.48 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.614 0.366 . . . . 0.0 111.685 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -72.23 -24.58 61.41 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -177.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -154.46 -53.52 0.1 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -169.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 22.7 p . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -171.309 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 . . . . . 0 CA--C 1.532 0.265 0 N-CA-C 111.44 0.163 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.6 tpt -55.03 -26.76 39.49 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.925 0.49 . . . . 0.0 112.166 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.25 -40.62 60.8 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.74 -20.3 62.65 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.565 -0.374 . . . . 0.0 110.514 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.4 -37.36 63.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 42.0 mt -77.5 -40.13 43.92 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.521 0.328 . . . . 0.0 110.302 177.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.46 -34.35 77.73 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.203 -0.311 . . . . 0.0 110.747 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 44.2 t -71.59 -37.36 70.99 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.092 0.405 . . . . 0.0 110.851 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.43 -23.87 65.58 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.247 0.219 . . . . 0.0 110.968 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -104.81 -11.75 16.63 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.146 -0.346 . . . . 0.0 111.289 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.0 -36.27 82.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -62.32 -35.76 80.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.654 0.381 . . . . 0.0 110.816 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 56.3 m -66.41 -11.82 53.72 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.548 0.574 . . . . 0.0 112.548 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 35.3 pt -129.4 13.16 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.926 -0.484 . . . . 0.0 111.545 -176.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.72 23.53 0.13 Allowed 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.599 0.76 . . . . 0.0 112.188 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.08 -178.53 5.75 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.753 -0.592 . . . . 0.0 111.826 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -63.74 -177.62 0.25 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.386 1.074 . . . . 0.0 112.503 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -134.3 156.62 78.81 Favored Pre-proline 0 CA--C 1.53 0.175 0 C-N-CA 123.466 0.707 . . . . 0.0 110.276 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.7 178.97 6.7 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 123.1 2.533 . . . . 0.0 110.622 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -146.47 -0.43 0.75 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.291 0.236 . . . . 0.0 111.456 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -63.01 -24.53 67.96 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.165 -0.334 . . . . 0.0 111.709 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.1 mtm -72.85 -29.8 63.49 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.217 0.207 . . . . 0.0 111.328 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.5 -14.37 43.28 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.1 -20.48 61.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.33 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.54 ' C ' ' H ' ' B' ' 54' ' ' LYS . 22.1 mt -76.69 -15.42 59.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 119.679 -0.201 . . . . 0.0 111.099 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -69.02 16.7 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.331 0.514 . . . . 0.0 111.13 173.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.54 ' H ' ' C ' ' B' ' 52' ' ' LEU . 53.7 mtmt -117.2 -3.77 11.47 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.456 1.102 . . . . 0.0 111.219 176.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -157.58 0.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.212 0 C-N-CA 123.281 0.632 . . . . 0.0 111.529 -179.385 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.5 m . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 42.3 tp -62.54 -27.27 69.05 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.111 -0.368 . . . . 0.0 110.687 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.46 -18.93 79.97 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-O 119.685 -0.508 . . . . 0.0 112.333 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -74.61 -2.31 25.44 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 117.984 0.892 . . . . 0.0 111.636 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -134.31 -21.37 1.82 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.18 0.592 . . . . 0.0 111.233 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.4 tp -75.59 -37.44 59.84 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.151 -0.343 . . . . 0.0 110.879 175.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.18 -46.75 99.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -173.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -73.0 -3.47 13.69 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.523 2.149 . . . . 0.0 112.968 -177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -129.22 11.11 5.89 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.311 0.505 . . . . 0.0 111.932 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.62 -46.26 99.85 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.21 -9.58 12.67 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 121.995 1.796 . . . . 0.0 112.427 -171.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.5 -32.52 73.45 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.505 0.593 . . . . 0.0 110.651 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.3 -18.22 61.81 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 122.368 -0.207 . . . . 0.0 111.047 -177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.6 mtm180 -98.88 -20.52 16.78 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.029 0.377 . . . . 0.0 110.773 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -61.42 -22.38 64.95 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 117.781 0.264 . . . . 0.0 110.74 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -130.34 -13.74 3.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.768 0.427 . . . . 0.0 110.876 175.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.19 73.82 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -68.17 -19.83 64.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 117.642 0.721 . . . . 0.0 111.052 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -100.93 4.3 42.47 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.623 0.769 . . . . 0.0 112.28 -175.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 59.9 mt -110.23 5.89 22.16 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.4 t -154.18 -20.43 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.964 0.802 . . . . 0.0 113.133 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.64 2.95 53.03 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 118.892 0.769 . . . . 0.0 114.225 174.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -154.82 146.31 23.11 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.658 1.229 . . . . 0.0 111.235 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -77.64 -17.92 57.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.926 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -70.92 -31.02 67.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -82.73 -32.57 27.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.798 0.439 . . . . 0.0 110.398 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.23 -39.94 81.99 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.33 -28.39 61.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.321 0.561 . . . . 0.0 110.4 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -69.26 -42.85 75.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.63 -42.14 95.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.217 -0.42 . . . . 0.0 111.656 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.7 m -67.64 -39.78 82.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.13 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -77.15 -29.26 54.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.515 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.03 -27.12 61.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.1 m -65.64 -40.48 92.56 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -40.92 26.26 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 121.082 -0.247 . . . . 0.0 111.068 -175.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -65.19 -24.65 67.43 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.221 -178.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.54 -1.16 23.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.267 0.627 . . . . 0.0 111.516 175.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 82.0 mt -118.14 -15.72 8.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.006 0.922 . . . . 0.0 109.763 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.18 -9.88 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.388 0.675 . . . . 0.0 111.333 175.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.2 -0.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.393 0.677 . . . . 0.0 110.898 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.21 57.51 1.49 Allowed Pre-proline 0 N--CA 1.452 -0.364 0 C-N-CA 123.29 0.636 . . . . 0.0 110.941 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -65.12 -11.0 27.85 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.086 2.524 . . . . 0.0 112.237 -177.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.17 -17.63 62.53 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.575 0.35 . . . . 0.0 110.653 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -83.3 0.8 44.13 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.999 0.52 . . . . 0.0 111.197 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -132.61 69.34 79.64 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.63 177.93 5.0 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 125.014 3.809 . . . . 0.0 112.197 -173.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 43.0 mmm-85 -123.56 7.09 8.89 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.727 0.811 . . . . 0.0 109.999 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -78.67 10.56 3.15 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.375 1.07 . . . . 0.0 111.844 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.47 171.85 16.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 C-N-CA 123.64 0.776 . . . . 0.0 109.843 -179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.413 ' C ' ' H ' ' A' ' 53' ' ' ARG . 10.5 m-20 -58.96 152.01 52.35 Favored Pre-proline 0 N--CA 1.453 -0.28 0 C-N-CA 122.605 0.362 . . . . 0.0 110.495 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -71.38 12.94 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.171 3.248 . . . . 0.0 111.749 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.413 ' H ' ' C ' ' A' ' 51' ' ' ASP . 28.5 mtp180 -131.6 -25.43 2.13 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.321 0.649 . . . . 0.0 110.856 -179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.3 tp -74.73 -35.94 62.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.38 -28.24 64.17 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.47 -46.01 88.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.14 0.576 . . . . 0.0 110.144 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -80.15 -27.01 39.12 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -65.31 -43.88 89.67 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 118.101 0.41 . . . . 0.0 111.179 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.9 mmm -74.4 -32.76 62.81 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.363 -178.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.6 -36.49 78.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.264 -0.273 . . . . 0.0 110.486 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.89 -26.17 66.75 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.782 0.433 . . . . 0.0 110.133 177.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.42 -39.89 69.18 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -74.19 -34.52 37.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.075 0 CA-C-N 117.794 0.797 . . . . 0.0 110.238 177.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -66.25 -33.02 74.8 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.438 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.41 -33.03 69.09 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 122.146 -0.347 . . . . 0.0 110.454 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -70.83 -25.92 63.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.5 -34.11 47.65 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.193 0.197 . . . . 0.0 110.717 177.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -71.94 -24.32 61.6 Favored 'General case' 0 C--N 1.34 0.178 0 O-C-N 122.14 -0.35 . . . . 0.0 110.336 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.22 0.58 18.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.194 0.598 . . . . 0.0 111.584 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -133.55 -1.03 3.16 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.092 0.557 . . . . 0.0 111.457 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.07 -4.72 83.16 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 122.145 -0.347 . . . . 0.0 112.957 177.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -74.07 -6.3 46.71 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -175.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.37 22.99 1.17 Allowed 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -78.83 4.2 14.67 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.123 -0.361 . . . . 0.0 111.214 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 8.9 t -152.46 168.11 26.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.774 0.83 . . . . 0.0 109.411 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.5 t -156.02 169.94 23.31 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 110.844 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -158.55 167.62 29.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.392 1.077 . . . . 0.0 108.821 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -69.55 170.07 11.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.276 0.56 . . . . 0.0 110.562 173.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -141.78 23.5 2.09 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.65 0.78 . . . . 0.0 108.967 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.73 -174.16 4.62 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.572 1.149 . . . . 0.0 109.577 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.73 11.57 5.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.068 0.547 . . . . 0.0 110.982 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.25 12.37 0.05 OUTLIER Glycine 0 CA--C 1.53 0.995 0 CA-C-O 119.193 -0.782 . . . . 0.0 113.122 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.2 p -138.4 -15.78 1.23 Allowed 'General case' 0 C--N 1.34 0.165 0 CA-C-N 118.373 1.087 . . . . 0.0 113.051 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -137.45 -30.84 0.83 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.12 -29.41 70.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 172.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.27 -35.65 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 122.521 0.329 . . . . 0.0 110.179 177.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.27 0.8 54.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.747 0.819 . . . . 0.0 112.319 -174.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.7 ppt_? -129.51 -18.84 3.49 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.201 0.455 . . . . 0.0 111.966 176.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.47 -14.54 61.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.047 0.385 . . . . 0.0 111.182 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -130.41 5.28 4.77 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' A' ' 93' ' ' ARG . 60.7 mt -138.68 18.8 2.69 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.172 0.589 . . . . 0.0 112.272 -177.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.29 4.87 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.406 ' H ' ' C ' ' A' ' 91' ' ' LEU . 96.7 mtt180 -130.1 8.31 5.16 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.801 0.728 . . . . 0.0 111.845 -178.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 60.0 tpp -63.62 150.94 43.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 85.4 m -64.12 139.96 97.79 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -52.73 -3.64 0.12 Allowed 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 124.739 3.626 . . . . 0.0 115.937 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -135.11 -24.98 1.4 Allowed 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.317 0.962 . . . . 0.0 112.285 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 90.4 p -69.38 -21.96 63.75 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.061 0.846 . . . . 0.0 109.432 174.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -68.09 -36.83 80.44 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -74.12 -36.14 64.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.34 73.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.736 -0.173 . . . . 0.0 110.81 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 46.8 tp -64.51 -46.91 80.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.458 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 6.2 mp -72.87 -11.35 60.56 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.239 -0.288 . . . . 0.0 111.178 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.0 tp -97.62 -7.37 31.22 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 p -140.59 0.67 1.66 Allowed 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.63 0.96 6.82 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.719 0.69 . . . . 0.0 111.575 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 5.7 ptp -156.29 21.84 0.36 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 177.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -146.27 -23.65 0.44 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.941 0.337 . . . . 0.0 111.798 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.03 8.55 83.21 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 118.797 -1.002 . . . . 0.0 114.728 170.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.21 145.95 49.4 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.336 1.568 . . . . 0.0 110.439 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 52.1 m -71.16 152.6 94.6 Favored Pre-proline 0 N--CA 1.455 -0.225 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.76 -27.16 32.94 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.621 2.881 . . . . 0.0 113.945 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -79.37 -39.07 33.47 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 118.061 0.392 . . . . 0.0 111.288 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -78.32 -31.22 48.68 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.27 -26.0 64.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.386 0.274 . . . . 0.0 111.063 176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.56 -33.33 41.89 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 122.386 0.274 . . . . 0.0 110.595 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -70.29 -27.17 64.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.63 0.372 . . . . 0.0 110.764 177.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 19.7 tp -76.68 -8.44 57.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 23.0 pt -136.08 13.17 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.23 0.468 . . . . 0.0 111.609 178.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.93 55.93 7.21 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 22.4 m -136.32 179.89 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 C-N-CA 123.114 0.565 . . . . 0.0 110.313 175.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -82.63 159.76 22.61 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 176.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.5 m -57.53 -40.22 78.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 122.007 -0.433 . . . . 0.0 110.89 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -72.51 -20.81 61.29 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.655 0.382 . . . . 0.0 111.849 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -72.53 -36.7 68.36 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.635 -0.666 . . . . 0.0 109.97 176.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.24 -38.45 82.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.19 -32.86 73.55 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.56 0.164 . . . . 0.0 110.726 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.4 m -78.45 -39.37 38.79 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.43 -0.169 . . . . 0.0 110.751 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -65.34 -32.38 74.0 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 119.333 -0.365 . . . . 0.0 111.6 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.3 m -82.8 -29.17 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 CA-C-N 118.586 0.63 . . . . 0.0 110.912 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 50.9 m -67.42 -38.36 84.47 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -78.5 -27.17 46.08 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.347 -0.221 . . . . 0.0 110.658 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.37 67.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 117.833 0.288 . . . . 0.0 110.769 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.52 -22.37 57.16 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.193 -0.317 . . . . 0.0 111.232 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.66 -38.11 67.74 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.71 -26.24 61.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.351 -0.218 . . . . 0.0 110.489 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 15.3 mm -74.2 -51.18 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.14 -23.06 66.41 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -84.13 -10.74 57.54 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -153.67 -54.44 0.11 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -177.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 N--CA 1.469 0.503 0 C-N-CA 125.872 1.669 . . . . 0.0 114.982 -166.62 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p30 . . . . . 0 CA--C 1.53 0.185 0 N-CA-C 111.479 0.178 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -62.26 -26.8 68.59 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 118.034 0.379 . . . . 0.0 111.656 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.57 -36.18 58.89 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.79 -24.47 58.66 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.968 0.384 . . . . 0.0 110.813 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.86 -45.48 70.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 84.2 mt -76.49 -36.46 57.82 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.598 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -65.5 -42.46 92.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -64.01 -42.05 97.26 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.355 0.525 . . . . 0.0 111.028 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.13 -29.39 70.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.561 0.219 . . . . 0.0 111.463 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -102.86 -12.49 17.51 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.125 -0.359 . . . . 0.0 111.331 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . 0.476 HE21 ' CG ' ' B' ' 41' ' ' GLU . 62.9 tp60 -69.16 -34.11 74.46 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 175.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -73.89 -24.71 59.75 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 121.068 -0.253 . . . . 0.0 110.937 176.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 26.6 m -73.14 -12.14 60.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 27.2 pt -123.25 18.02 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.097 0 O-C-N 121.814 -0.554 . . . . 0.0 112.464 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . 0.476 ' CG ' HE21 ' B' ' 37' ' ' GLN . 74.0 mm-40 -132.85 25.29 4.32 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -177.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.42 -15.77 0.84 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -166.41 158.8 14.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.179 0.9 . . . . 0.0 111.451 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.84 150.49 59.89 Favored Pre-proline 0 C--O 1.233 0.185 0 C-N-CA 124.318 1.047 . . . . 0.0 108.536 171.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . 0.46 ' C ' ' H ' ' B' ' 47' ' ' GLU . 72.1 Cg_endo -73.83 -35.78 4.14 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.016 2.478 . . . . 0.0 112.588 -177.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.2 t70 49.28 -10.49 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 127.481 2.312 . . . . 0.0 116.231 -177.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.46 ' H ' ' C ' ' B' ' 45' ' ' PRO . 15.7 pt-20 -69.4 -16.97 63.61 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.921 -1.112 . . . . 0.0 111.831 -177.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 42.0 mtm -74.09 -12.22 60.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.95 0.5 . . . . 0.0 111.297 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 87.9 mt -108.37 -17.28 14.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -68.19 -21.08 64.89 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.427 ' O ' ' HE2' ' B' ' 54' ' ' LYS . 4.2 pp -98.68 -6.82 28.92 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 122.881 0.472 . . . . 0.0 112.174 177.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.502 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.9 mt -89.9 -15.19 32.66 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.918 0.781 . . . . 0.0 109.906 166.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.59 22.68 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.532 1.133 . . . . 0.0 111.296 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.502 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.5 pttt -135.16 -4.11 2.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.78 0.832 . . . . 0.0 112.087 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -155.96 -5.83 0.12 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.143 0 CA-C-N 118.958 0.799 . . . . 0.0 112.853 -176.831 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 m . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 111.524 0.194 . . . . 0.0 111.524 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.1 tp -52.63 -30.81 33.51 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.485 0.714 . . . . 0.0 112.597 -177.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.97 -20.79 78.06 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.427 -176.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -79.07 -1.0 33.68 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 117.42 0.61 . . . . 0.0 111.684 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -134.1 -13.88 2.4 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.452 0.301 . . . . 0.0 111.594 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 tp -80.23 -42.08 23.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.197 -0.314 . . . . 0.0 110.166 173.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.42 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.37 -45.47 99.86 Favored Pre-proline 0 CA--C 1.531 0.219 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -175.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 74.3 Cg_endo -70.64 -4.16 14.05 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.373 2.048 . . . . 0.0 112.177 -178.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.31 10.17 4.84 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.405 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 48.3 mt -57.26 -40.34 84.0 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.351 -0.833 . . . . 0.0 112.434 173.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.405 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 88.1 Cg_endo -77.87 -16.47 14.44 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 CA-C-N 120.842 1.337 . . . . 0.0 112.634 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -69.66 -24.98 63.69 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 118.435 0.561 . . . . 0.0 109.867 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.71 -21.65 65.3 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 175.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -92.46 -22.19 19.74 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.488 0.315 . . . . 0.0 110.386 178.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.3 ttp180 -52.69 -29.02 24.34 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 124.271 1.028 . . . . 0.0 110.773 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -138.27 -9.69 1.49 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 111.433 0.16 . . . . 0.0 111.433 177.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.96 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.89 -29.98 66.21 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.99 0.895 . . . . 0.0 110.264 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.23 -2.01 32.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.431 0.692 . . . . 0.0 111.358 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.3 mt -114.9 5.13 15.02 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.629 0.772 . . . . 0.0 111.501 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.8 p -141.6 -22.63 0.73 Allowed 'General case' 0 C--O 1.231 0.109 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.86 17.29 50.14 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.287 0.494 . . . . 0.0 112.08 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.2 t -153.45 131.97 12.16 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.62 0.71 . . . . 0.0 110.023 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.94 -20.77 64.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.872 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -70.94 -38.5 72.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.065 0.393 . . . . 0.0 110.578 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -82.19 -28.25 32.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.21 0.204 . . . . 0.0 110.745 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.6 -39.03 26.56 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.781 -0.927 . . . . 0.0 110.781 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -73.31 -30.37 63.33 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.283 0.542 . . . . 0.0 111.088 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -25.22 27.68 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 120.178 -0.609 . . . . 0.0 111.413 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -63.57 -37.91 89.13 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.076 0.853 . . . . 0.0 109.442 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.3 t -63.79 -46.65 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 117.704 0.229 . . . . 0.0 110.772 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -79.21 -32.59 44.05 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.534 -175.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.53 -25.99 63.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.13 -43.76 94.28 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.88 -41.28 62.42 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.573 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -62.46 -26.75 68.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.121 -0.362 . . . . 0.0 111.823 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.59 0.63 29.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.898 0.479 . . . . 0.0 111.363 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 72.6 mt -120.66 -13.47 8.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.227 1.011 . . . . 0.0 109.866 -177.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.6 t -58.83 -11.48 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 123.62 0.768 . . . . 0.0 111.921 175.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.75 3.0 9.52 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 123.47 0.708 . . . . 0.0 110.579 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.12 53.66 0.96 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 123.888 0.875 . . . . 0.0 110.978 -174.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.23 -10.12 27.97 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.933 2.422 . . . . 0.0 113.264 -175.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -78.96 -17.84 54.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.415 0.552 . . . . 0.0 110.654 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -78.56 -1.19 32.81 Favored 'General case' 0 C--N 1.335 -0.062 0 C-N-CA 125.025 1.33 . . . . 0.0 111.464 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -131.26 60.51 53.3 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 123.559 0.744 . . . . 0.0 109.995 -176.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.25 171.52 15.88 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 124.057 3.172 . . . . 0.0 111.409 -176.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -115.51 12.84 16.29 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.167 0.987 . . . . 0.0 109.658 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -72.27 10.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.71 1.204 . . . . 0.0 111.507 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.95 174.87 12.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 124.386 1.074 . . . . 0.0 109.504 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -55.4 148.05 34.78 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -68.34 10.62 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 123.865 3.043 . . . . 0.0 112.139 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -129.08 -25.06 2.8 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.012 0.525 . . . . 0.0 111.18 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.82 -32.98 68.13 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.522 0.601 . . . . 0.0 110.189 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.38 -34.14 57.91 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 177.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.39 -43.65 96.98 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.961 0.381 . . . . 0.0 109.992 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.14 -32.23 44.32 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -62.46 -41.12 98.53 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.179 -0.326 . . . . 0.0 110.959 -178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -80.93 -29.94 35.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.665 -177.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -66.86 -35.89 81.08 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -67.38 -27.68 67.3 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.114 0.566 . . . . 0.0 109.807 176.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.07 -39.86 92.96 Favored Glycine 0 CA--C 1.528 0.871 0 CA-C-O 119.796 -0.447 . . . . 0.0 112.055 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 48.6 mm -72.9 -37.97 55.55 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.071 0 CA-C-N 118.132 0.966 . . . . 0.0 110.264 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -31.79 70.1 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -31.4 61.56 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 121.309 -0.869 . . . . 0.0 110.503 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.8 t -75.52 -28.04 58.96 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.587 0.355 . . . . 0.0 110.988 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.92 70.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 122.158 -0.339 . . . . 0.0 110.124 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -72.57 -16.03 61.75 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.382 -0.199 . . . . 0.0 110.954 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.27 4.36 39.28 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.888 0.475 . . . . 0.0 110.968 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -133.29 -4.33 3.03 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.41 0.684 . . . . 0.0 111.128 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.39 -4.98 62.45 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.591 -0.561 . . . . 0.0 113.186 175.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -67.17 135.07 52.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.891 0.845 . . . . 0.0 110.31 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -165.69 173.57 10.63 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.451 0.701 . . . . 0.0 110.58 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -147.37 168.52 21.61 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 124.231 1.012 . . . . 0.0 109.085 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.4 t -64.9 -21.37 66.8 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.795 0.438 . . . . 0.0 111.363 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 92.1 p 44.72 24.16 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.767 1.627 . . . . 0.0 114.226 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -56.01 -60.41 3.52 Favored 'General case' 0 CA--C 1.527 0.065 0 C-N-CA 123.139 0.576 . . . . 0.0 111.572 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 81.0 p -178.79 177.53 0.86 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 123.558 0.743 . . . . 0.0 110.635 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -138.18 17.74 2.79 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.365 1.066 . . . . 0.0 108.797 175.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.62 -173.59 4.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.188 0.995 . . . . 0.0 110.219 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -139.81 10.8 2.44 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.787 0.435 . . . . 0.0 112.014 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -167.62 9.28 0.05 OUTLIER Glycine 0 CA--C 1.529 0.958 0 CA-C-O 119.359 -0.689 . . . . 0.0 113.721 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.5 t -147.4 7.52 0.88 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.471 1.135 . . . . 0.0 111.946 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -152.43 -33.07 0.13 Allowed 'General case' 0 CA--C 1.528 0.117 0 O-C-N 121.935 -0.478 . . . . 0.0 109.79 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.12 -23.71 63.07 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.9 p -66.84 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.138 0 C-N-CA 122.664 0.386 . . . . 0.0 110.03 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.7 -17.12 52.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 122.732 0.413 . . . . 0.0 111.137 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -88.1 -51.34 5.85 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.26 -1.67 4.86 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -171.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -130.22 6.22 4.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.015 0.526 . . . . 0.0 111.996 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 84.9 mt -144.5 19.27 1.7 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.791 0.836 . . . . 0.0 110.782 -178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.51 5.95 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -130.39 0.97 4.57 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.337 0.971 . . . . 0.0 112.255 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 ttm -68.17 152.15 45.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.2 m -59.25 137.88 88.5 Favored Pre-proline 0 CA--C 1.532 0.251 0 C-N-CA 123.178 0.591 . . . . 0.0 109.667 176.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.36 5.42 1.55 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.933 3.089 . . . . 0.0 114.01 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -130.95 -32.68 1.62 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.632 0.651 . . . . 0.0 110.298 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.6 m -62.64 -19.38 63.74 Favored 'General case' 0 CA--C 1.527 0.069 0 O-C-N 121.852 -0.53 . . . . 0.0 110.39 173.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.83 -33.84 76.78 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.071 0.548 . . . . 0.0 110.517 175.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -77.59 -30.37 52.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.53 -32.35 73.07 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.07 -0.394 . . . . 0.0 110.289 175.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 38.2 tp -66.32 -44.13 84.25 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.763 0.425 . . . . 0.0 110.438 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.87 -10.01 59.08 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.456 0.571 . . . . 0.0 111.677 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.8 mt -96.58 -4.71 40.73 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 67.7 p -137.19 6.05 2.8 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -177.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -139.54 10.55 2.49 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 177.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.5 mtm -140.07 -10.11 1.14 Allowed 'General case' 0 C--N 1.341 0.216 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -148.1 -8.25 0.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.225 0.92 . . . . 0.0 112.634 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 70.22 20.0 76.26 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.296 -0.724 . . . . 0.0 113.848 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -58.0 150.6 20.38 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.64 1.22 . . . . 0.0 109.884 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.2 p -70.24 160.79 79.61 Favored Pre-proline 0 C--O 1.233 0.207 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.82 -16.07 45.25 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 121.933 1.755 . . . . 0.0 110.521 176.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -79.28 -37.43 37.85 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 117.94 0.336 . . . . 0.0 110.823 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -76.95 -36.09 56.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 117.938 0.335 . . . . 0.0 110.129 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.0 -27.53 64.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.591 -0.243 . . . . 0.0 111.227 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.97 -36.44 64.58 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.727 0.298 . . . . 0.0 110.575 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -68.52 -31.11 70.13 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.861 0.465 . . . . 0.0 110.688 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.86 -7.45 57.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 8.6 pt -135.72 13.92 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.739 0.699 . . . . 0.0 111.992 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 56.8 53.61 8.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 29.1 m -137.16 179.13 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 122.936 0.494 . . . . 0.0 110.399 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.31 161.32 20.48 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.758 0.423 . . . . 0.0 110.178 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.7 m -60.74 -36.55 79.19 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.057 -0.402 . . . . 0.0 110.919 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -23.95 61.48 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.371 0.268 . . . . 0.0 110.946 -178.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.39 -36.55 68.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.789 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.7 t -64.81 -36.5 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -62.87 -34.57 77.66 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.651 0.263 . . . . 0.0 110.594 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.1 m -77.03 -37.52 54.74 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 177.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mp -66.46 -32.79 74.38 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.074 -0.489 . . . . 0.0 111.694 -178.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.62 -26.59 12.52 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.873 0.761 . . . . 0.0 110.811 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 99.0 m -68.89 -37.72 79.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -76.34 -27.62 56.56 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 122.273 -0.267 . . . . 0.0 110.319 176.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.4 -48.07 62.22 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.852 0.296 . . . . 0.0 110.471 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.87 -22.74 65.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 117.855 0.298 . . . . 0.0 111.129 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.44 -38.62 59.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 173.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -69.46 -30.11 67.94 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 119.757 -0.163 . . . . 0.0 110.571 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.9 mm -64.71 -49.41 80.35 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.69 -20.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -77.76 -20.88 52.61 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -176.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -151.69 -10.63 0.21 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.4 p . . . . . 0 N--CA 1.464 0.257 0 CA-C-N 119.951 1.25 . . . . 0.0 112.164 179.092 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 . . . . . 0 CA--C 1.528 0.113 0 CA-C-O 120.672 0.272 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.2 tpt -52.93 -26.97 16.71 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.634 0.773 . . . . 0.0 112.349 -177.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.22 -40.54 87.7 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.24 -22.7 60.36 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.549 -0.383 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.88 -37.83 67.18 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 81.7 mt -73.97 -37.41 64.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.98 -32.45 72.86 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 119.533 -0.27 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 62.3 m -66.62 -43.86 83.62 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.221 0.464 . . . . 0.0 110.705 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -26.97 65.12 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -103.7 -16.54 15.43 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 122.111 -0.368 . . . . 0.0 111.526 -176.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tp60 -64.45 -33.67 76.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 169.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -55.15 -38.66 68.54 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.157 0.583 . . . . 0.0 110.646 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 95.6 m -67.06 -12.61 60.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.835 0.454 . . . . 0.0 112.208 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 69.6 mt -105.54 -14.89 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.048 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -75.54 19.51 0.19 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.855 0.462 . . . . 0.0 111.53 176.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -136.48 169.05 18.31 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.054 0.454 . . . . 0.0 111.055 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -56.37 165.31 1.11 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.761 1.224 . . . . 0.0 113.129 -173.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.5 m -125.92 155.61 72.79 Favored Pre-proline 0 C--O 1.232 0.169 0 C-N-CA 124.022 0.929 . . . . 0.0 109.663 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.9 179.62 6.32 Favored 'Trans proline' 0 N--CA 1.448 -1.152 0 C-N-CA 122.938 2.425 . . . . 0.0 109.898 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -146.77 0.25 0.75 Allowed 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.589 0.356 . . . . 0.0 111.071 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -67.81 -18.13 64.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -175.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.9 mpp? -70.22 -29.15 65.9 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-N 118.204 0.456 . . . . 0.0 109.8 176.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -93.31 -25.02 17.92 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.49 -20.88 66.53 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.4 pp -98.11 0.61 46.39 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.492 0.317 . . . . 0.0 111.626 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.463 ' C ' ' H ' ' B' ' 54' ' ' LYS . 23.8 mt -83.84 -21.83 31.92 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 166.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -66.12 17.28 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.1 0.96 . . . . 0.0 113.155 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.463 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.4 pttt -128.12 6.18 5.92 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.427 0.691 . . . . 0.0 111.236 177.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.2 -15.51 0.35 Allowed 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.107 0.563 . . . . 0.0 111.591 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.342 0 CA-C-N 117.935 0.334 . . . . 0.0 110.697 171.184 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.233 0.225 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.52 -26.68 66.45 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.335 0.654 . . . . 0.0 111.228 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.95 -23.14 78.41 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.744 -0.598 . . . . 0.0 112.046 -176.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -81.17 2.99 25.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.865 0.466 . . . . 0.0 111.004 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -131.51 -21.71 2.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.532 0.733 . . . . 0.0 111.089 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.3 tp -78.55 -38.79 39.54 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.298 -0.251 . . . . 0.0 110.926 176.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.8 -45.78 99.78 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -172.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -72.86 -3.84 14.31 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.487 2.125 . . . . 0.0 113.285 -175.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -135.71 8.7 3.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.368 0.531 . . . . 0.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.8 tp -56.38 -44.03 99.55 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 124.14 0.976 . . . . 0.0 113.107 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -81.8 -11.76 11.26 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.203 1.936 . . . . 0.0 113.373 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -64.9 -23.49 67.24 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 118.942 0.792 . . . . 0.0 111.255 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.75 -19.03 65.67 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 122.252 -0.28 . . . . 0.0 110.9 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm105 -103.03 -20.91 14.02 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.702 0.401 . . . . 0.0 111.042 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -62.84 -16.43 58.44 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.364 0.529 . . . . 0.0 111.805 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -140.32 -21.3 0.84 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.578 0.351 . . . . 0.0 111.449 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.66 -25.1 68.61 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 111.56 -0.616 . . . . 0.0 111.56 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -66.86 -12.12 58.11 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.386 0.593 . . . . 0.0 111.977 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -114.12 -6.45 13.07 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 122.962 0.505 . . . . 0.0 111.881 -174.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.5 mt -82.76 -0.36 47.34 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.04 0.382 . . . . 0.0 111.22 174.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 t -148.29 -4.13 0.47 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -175.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.16 17.04 78.54 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 121.553 -0.717 . . . . 0.0 113.034 174.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.3 t -156.1 126.23 6.56 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.143 0.971 . . . . 0.0 110.272 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -69.32 -19.04 63.88 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.715 -0.22 . . . . 0.0 110.78 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -74.29 -33.14 63.15 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -76.46 -35.11 58.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -71.36 -36.1 63.28 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -73.02 -34.67 66.5 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 117.565 0.682 . . . . 0.0 111.451 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.82 -22.93 49.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.431 178.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -67.32 -36.79 82.19 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 37.3 t -60.4 -47.01 94.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 CA-C-N 117.932 0.333 . . . . 0.0 110.58 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -77.38 -29.86 53.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.511 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.67 -27.39 61.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.604 -0.147 . . . . 0.0 110.604 176.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 59.4 m -66.93 -38.9 87.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.43 -44.1 53.34 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -176.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.3 -24.67 67.74 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 122.081 -0.387 . . . . 0.0 110.522 -178.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.38 0.16 23.48 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.378 0.671 . . . . 0.0 111.636 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.5 mt -122.7 -14.02 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 124.008 0.923 . . . . 0.0 109.879 -177.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.0 t -58.92 -15.54 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.142 0.577 . . . . 0.0 112.021 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.19 4.98 9.77 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.344 0.658 . . . . 0.0 110.884 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.18 53.88 0.91 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.144 0.578 . . . . 0.0 111.199 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -64.7 -10.83 26.26 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.291 2.66 . . . . 0.0 112.405 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.57 -15.34 61.29 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.494 0.318 . . . . 0.0 110.878 175.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -85.68 0.5 52.54 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.722 0.409 . . . . 0.0 111.664 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -129.17 63.99 69.3 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 122.799 0.44 . . . . 0.0 110.296 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.24 168.36 21.1 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 124.214 3.276 . . . . 0.0 111.918 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.53 12.17 10.73 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.054 0.942 . . . . 0.0 109.795 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -72.68 10.68 0.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.196 0.998 . . . . 0.0 111.52 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.4 m -135.86 174.69 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 C-N-CA 124.2 1.0 . . . . 0.0 109.216 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.31 146.23 32.92 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.104 0.161 . . . . 0.0 110.824 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.07 11.78 0.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 124.242 3.294 . . . . 0.0 112.37 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -128.75 -16.6 4.18 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.028 0.531 . . . . 0.0 110.428 174.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.63 -35.87 38.75 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 118.136 0.426 . . . . 0.0 109.888 -178.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.61 -32.63 45.68 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.2 -46.6 89.17 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.059 0.543 . . . . 0.0 110.214 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -74.05 -33.85 63.85 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.721 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.6 tpm_? -63.77 -43.15 97.23 Favored 'General case' 0 C--N 1.337 0.05 0 CA-C-N 118.728 0.695 . . . . 0.0 111.116 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 88.8 mmm -71.0 -34.38 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.576 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -68.82 -37.07 78.94 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.325 -0.234 . . . . 0.0 110.748 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -67.94 -20.17 65.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.509 0.323 . . . . 0.0 110.377 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.1 -40.41 50.81 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.4 mm -73.61 -34.34 41.47 Favored 'Isoleucine or valine' 0 C--N 1.338 0.089 0 CA-C-N 117.552 0.676 . . . . 0.0 109.852 176.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.0 t90 -65.54 -36.36 83.57 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.419 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.06 69.53 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.082 -0.386 . . . . 0.0 110.563 177.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.1 t -75.07 -28.93 60.53 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.317 0.247 . . . . 0.0 110.743 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.02 64.77 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.334 -0.229 . . . . 0.0 111.049 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -86.64 -12.84 47.32 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.465 0.306 . . . . 0.0 110.758 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.4 4.56 34.84 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.191 0.596 . . . . 0.0 111.131 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -137.7 0.82 2.27 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.107 0.563 . . . . 0.0 111.033 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.34 13.13 83.12 Favored Glycine 0 CA--C 1.528 0.885 0 CA-C-O 119.676 -0.514 . . . . 0.0 113.12 176.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -64.25 -18.38 64.5 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 117.949 0.875 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.42 155.15 31.61 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.119 0.968 . . . . 0.0 109.095 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -146.89 -10.68 0.45 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.8 t -164.52 174.52 10.82 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.767 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.7 p -155.82 167.3 30.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.736 0.814 . . . . 0.0 110.087 177.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -152.29 -50.34 0.11 Allowed 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 122.452 -0.155 . . . . 0.0 111.279 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -169.31 160.49 9.49 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.506 0.322 . . . . 0.0 110.985 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -160.24 23.73 0.16 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.082 0.953 . . . . 0.0 110.037 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.39 174.75 10.47 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.163 0.506 . . . . 0.0 111.227 -176.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -9.38 17.32 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.86 -11.79 0.14 Allowed Glycine 0 CA--C 1.527 0.828 0 CA-C-O 119.566 -0.575 . . . . 0.0 113.121 178.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.5 p -66.65 -3.54 6.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.295 1.047 . . . . 0.0 113.066 -176.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -129.19 -29.76 2.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.92 68.27 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -65.89 -29.86 48.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.444 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -0.06 53.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.395 0.678 . . . . 0.0 111.809 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -130.48 -16.59 3.43 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.865 0.302 . . . . 0.0 111.229 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.45 -1.42 15.67 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.855 0.462 . . . . 0.0 110.447 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -130.49 -12.87 3.88 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.352 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 73.8 mt -144.82 34.21 1.13 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.338 0.655 . . . . 0.0 111.247 -171.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.7 2.88 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -130.52 -5.92 4.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.532 1.06 . . . . 0.0 112.3 -177.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.8 ttm -67.35 146.05 54.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.325 0.511 . . . . 0.0 110.31 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 93.9 m -65.65 137.25 96.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.83 -20.75 39.05 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.578 2.185 . . . . 0.0 112.956 -174.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -78.61 -34.73 46.43 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.3 m -65.36 -23.41 66.98 Favored 'General case' 0 N--CA 1.457 -0.105 0 O-C-N 122.043 -0.411 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 62.6 mtm180 -67.88 -26.0 65.79 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.063 0.392 . . . . 0.0 110.556 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -77.72 -39.0 45.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.57 -33.25 74.65 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 122.082 -0.386 . . . . 0.0 110.202 177.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -54.43 46.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.974 0.509 . . . . 0.0 109.721 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.481 ' HA ' ' HE2' ' A' ' 107' ' ' MET . 4.4 pp -71.53 -15.44 62.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.1 mt -84.24 -9.3 58.63 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.882 0.31 . . . . 0.0 111.827 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.4 p -135.44 12.47 3.5 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -132.48 -0.65 3.57 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.481 ' HE2' ' HA ' ' A' ' 103' ' ' LEU . 33.3 mtm -145.9 -11.79 0.5 Allowed 'General case' 0 C--N 1.34 0.173 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -138.09 -2.91 1.82 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.23 0.923 . . . . 0.0 112.266 -175.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 55.58 26.47 45.81 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.167 -0.796 . . . . 0.0 114.315 173.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -56.68 151.62 13.63 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.493 1.146 . . . . 0.0 110.633 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.4 t -64.55 149.38 95.46 Favored Pre-proline 0 N--CA 1.453 -0.285 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 171.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -64.44 -16.54 55.67 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.938 1.759 . . . . 0.0 110.648 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -76.18 -39.85 53.81 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 117.767 0.258 . . . . 0.0 110.344 176.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -74.63 -35.26 62.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 122.119 -0.363 . . . . 0.0 110.312 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.04 -28.1 67.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.22 -0.3 . . . . 0.0 111.053 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.32 -27.69 42.1 Favored 'General case' 0 CA--C 1.526 0.05 0 C-N-CA 122.541 0.336 . . . . 0.0 110.403 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -75.13 -22.62 58.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.258 1.023 . . . . 0.0 111.037 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 69.8 mt -88.49 -7.88 55.8 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 7.5 pt -135.55 15.23 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.726 0.694 . . . . 0.0 111.351 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 46.13 62.17 2.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.952 1.701 . . . . 0.0 114.691 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 31.2 m -136.9 -179.78 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 C-N-CA 124.077 0.951 . . . . 0.0 109.392 174.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -81.41 159.93 24.19 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -60.6 -36.87 79.62 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 122.152 -0.342 . . . . 0.0 110.799 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.0 t -72.91 -24.64 60.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.134 0.174 . . . . 0.0 110.932 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.95 -34.14 68.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.085 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.9 t -65.72 -38.04 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.109 0 CA-C-N 118.211 0.46 . . . . 0.0 109.769 177.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.66 -35.78 77.07 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.7 m -76.29 -37.98 56.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.342 -0.224 . . . . 0.0 110.743 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mp -65.17 -36.19 83.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.666 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.44 -28.5 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-N 118.515 0.598 . . . . 0.0 110.974 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.7 m -68.67 -38.79 80.65 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -78.17 -26.17 47.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 122.356 -0.215 . . . . 0.0 110.638 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.21 -50.74 37.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.57 -22.51 65.38 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 117.73 0.241 . . . . 0.0 111.1 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.29 -34.77 76.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -81.59 -18.62 44.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.261 176.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 25.9 mm -68.91 -53.13 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 173.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.65 -16.83 62.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -64.91 -21.44 66.82 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -155.57 -43.32 0.08 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -171.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -169.097 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 25.0 t70 . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 120.92 0.391 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -64.42 -25.65 68.11 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.968 0.507 . . . . 0.0 112.136 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.48 -34.69 60.14 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.63 -18.54 60.54 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 117.325 0.562 . . . . 0.0 110.865 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.63 -41.15 27.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 62.0 mt -71.02 -41.56 70.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.255 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -70.84 -25.9 63.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.928 -0.482 . . . . 0.0 111.314 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 45.5 t -64.74 -44.82 88.89 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.791 0.723 . . . . 0.0 109.769 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.4 -24.62 65.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -105.36 -1.51 25.02 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 122.088 -0.382 . . . . 0.0 111.62 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -79.79 -40.09 29.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -66.88 -16.88 64.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 175.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -88.01 -8.34 55.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.371 0.668 . . . . 0.0 112.496 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 7.2 tp -123.22 -7.95 7.88 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 CA-C-N 119.334 0.97 . . . . 0.0 112.909 -173.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -80.6 33.62 0.31 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.173 0.589 . . . . 0.0 112.036 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -130.87 175.57 8.95 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.113 0.482 . . . . 0.0 111.918 -174.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -64.04 178.05 0.71 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.704 1.201 . . . . 0.0 112.747 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.59 156.04 74.96 Favored Pre-proline 0 CA--C 1.53 0.192 0 C-N-CA 122.918 0.487 . . . . 0.0 110.998 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -77.67 -178.86 4.92 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.577 2.851 . . . . 0.0 110.044 173.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -148.65 -1.9 0.5 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -66.51 -20.49 66.04 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.939 -0.476 . . . . 0.0 111.905 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 3.1 mpp? -67.93 -36.81 80.77 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 82.6 mt -83.43 -12.46 56.38 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.117 -0.364 . . . . 0.0 110.213 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -72.43 -20.57 61.39 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.937 -0.477 . . . . 0.0 109.882 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -73.63 -19.57 60.82 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 173.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.468 ' C ' ' H ' ' B' ' 54' ' ' LYS . 15.8 mt -78.93 -22.6 45.53 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.136 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -73.41 9.38 1.35 Allowed 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 172.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.468 ' H ' ' C ' ' B' ' 52' ' ' LEU . 36.9 ttpt -120.72 -0.55 10.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.064 1.346 . . . . 0.0 110.588 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.2 pp -149.65 -15.36 0.27 Allowed 'General case' 0 C--N 1.345 0.374 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 CA-C-N 118.668 0.667 . . . . 0.0 112.399 -178.671 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m . . . . . 0 CA--C 1.534 0.329 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.6 tp -63.42 -30.56 71.67 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 122.186 -0.321 . . . . 0.0 111.488 -177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -65.66 -35.42 91.06 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.3 mp0 -73.4 3.33 6.11 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.399 0.68 . . . . 0.0 111.115 177.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -128.42 0.58 5.65 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.283 0.633 . . . . 0.0 111.078 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.66 -39.54 2.74 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.952 0.501 . . . . 0.0 111.091 177.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.99 -44.78 99.62 Favored Pre-proline 0 CA--C 1.53 0.209 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -175.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -75.71 3.48 5.93 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.173 1.916 . . . . 0.0 111.907 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -130.28 9.42 5.19 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.9 mt -54.86 -44.24 99.29 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.58 -15.0 11.24 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 121.715 1.61 . . . . 0.0 112.708 -175.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -71.59 -25.33 62.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.462 0.573 . . . . 0.0 111.221 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.9 mt -69.53 -27.32 65.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 118.145 0.429 . . . . 0.0 110.009 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -88.76 -29.18 19.98 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.53 0.732 . . . . 0.0 110.544 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.5 ttp180 -53.83 -25.58 20.2 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.674 1.19 . . . . 0.0 112.759 -175.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -140.56 -20.98 0.83 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.25 -27.99 70.09 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -69.26 -33.01 72.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 117.557 0.679 . . . . 0.0 110.289 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.95 -11.44 59.9 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.0 mt -86.07 4.39 38.34 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.03 0.377 . . . . 0.0 111.213 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.8 t -149.31 -18.13 0.28 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.97 11.24 82.87 Favored Glycine 0 CA--C 1.526 0.719 0 CA-C-O 119.47 -0.628 . . . . 0.0 113.75 171.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -148.28 140.03 23.79 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.349 1.075 . . . . 0.0 110.864 -179.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -73.36 -19.22 61.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.365 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -73.72 -37.68 65.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 178.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -79.67 -32.59 41.49 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 176.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.4 -47.1 82.49 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.81 -33.02 74.73 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.594 0.697 . . . . 0.0 110.313 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HE3' ' CE1' ' A' ' 31' ' ' TYR . 5.9 tmmm? -67.5 -46.78 71.93 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.63 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.476 ' CE1' ' HE3' ' A' ' 30' ' ' LYS . 22.7 m-85 -69.06 -36.07 77.24 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.392 0.542 . . . . 0.0 111.552 -178.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 t -60.81 -52.25 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -77.29 -27.83 53.14 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 122.423 -0.173 . . . . 0.0 111.375 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -24.24 63.23 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.721 -0.181 . . . . 0.0 110.847 175.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.0 m -67.82 -40.08 83.83 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.59 -42.25 61.81 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -59.63 -25.49 64.71 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.995 -0.44 . . . . 0.0 111.858 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 0.49 31.33 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.797 0.439 . . . . 0.0 111.011 178.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 81.6 mt -120.9 -13.89 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -61.79 -10.64 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.87 0.868 . . . . 0.0 111.708 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.7 3.0 9.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.001 0.52 . . . . 0.0 111.296 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.1 55.36 0.97 Allowed Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.385 0.674 . . . . 0.0 110.304 -177.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.47 -10.63 28.45 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 123.318 2.679 . . . . 0.0 112.753 -173.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -81.52 -11.69 59.09 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 122.067 -0.395 . . . . 0.0 111.005 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -86.73 -14.61 41.92 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -65.31 114.9 17.26 Favored Pre-proline 0 CA--C 1.529 0.165 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -78.78 135.29 12.64 Favored 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 122.991 2.461 . . . . 0.0 112.193 -174.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -125.76 1.91 7.45 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 125.054 1.342 . . . . 0.0 109.976 175.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -79.42 9.56 4.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.086 0.954 . . . . 0.0 111.719 -178.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.3 m -137.93 -179.08 2.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 C-N-CA 123.846 0.858 . . . . 0.0 109.967 -176.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -52.65 152.96 6.07 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.301 0.641 . . . . 0.0 110.81 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.78 7.3 0.59 Allowed 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.383 3.389 . . . . 0.0 112.588 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -127.17 -25.02 3.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.221 0.608 . . . . 0.0 110.843 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 28.7 mt -70.31 -33.9 72.08 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.039 0.381 . . . . 0.0 110.648 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.97 -41.0 93.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.62 -42.47 91.5 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.975 0.51 . . . . 0.0 109.977 177.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -77.47 -30.25 53.07 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -175.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -66.12 -41.99 89.76 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.71 0.687 . . . . 0.0 110.754 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.1 mmm -71.12 -34.76 71.37 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.502 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -71.0 -35.07 71.94 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 117.618 0.19 . . . . 0.0 110.752 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.25 -27.65 68.8 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.516 0.326 . . . . 0.0 110.204 177.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -72.71 -36.39 58.23 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -70.59 -38.24 72.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.101 0 CA-C-N 117.657 0.729 . . . . 0.0 110.142 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 76.0 t90 -69.29 -32.04 70.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 122.251 -0.281 . . . . 0.0 110.897 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.82 -32.94 68.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 122.099 -0.376 . . . . 0.0 110.179 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -74.11 -25.49 59.81 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.597 0.359 . . . . 0.0 110.484 178.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.38 65.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 122.392 -0.192 . . . . 0.0 110.626 179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -69.79 -16.52 63.3 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.115 -0.366 . . . . 0.0 110.614 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.48 7.51 46.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.23 0.612 . . . . 0.0 111.208 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -134.24 -4.89 2.68 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 111.66 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 112.88 25.56 4.46 Favored Glycine 0 C--N 1.341 0.825 0 C-N-CA 120.911 -0.662 . . . . 0.0 114.372 173.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -128.64 171.53 12.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.558 1.179 . . . . 0.0 110.637 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 51.01 25.69 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.195 0.998 . . . . 0.0 112.576 -176.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -67.51 -7.19 23.85 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -152.42 -19.87 0.17 Allowed 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.292 0.496 . . . . 0.0 111.706 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.0 m 49.85 26.4 1.92 Allowed 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -56.54 153.12 10.63 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.767 0.427 . . . . 0.0 110.071 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.4 p -136.47 170.68 15.66 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.791 0.436 . . . . 0.0 110.922 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -152.92 23.3 0.57 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.946 0.498 . . . . 0.0 111.291 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.72 162.03 2.51 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.958 -0.464 . . . . 0.0 111.734 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.25 -13.55 62.33 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -173.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.62 20.39 0.06 OUTLIER Glycine 0 CA--C 1.527 0.791 0 CA-C-O 119.421 -0.655 . . . . 0.0 113.448 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 8.9 t -134.18 5.45 3.54 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.304 1.052 . . . . 0.0 112.322 -176.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -150.97 -30.1 0.19 Allowed 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.42 -22.79 65.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.6 p -71.53 -29.9 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.586 0.354 . . . . 0.0 110.328 176.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.71 7.7 28.94 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.774 0.83 . . . . 0.0 111.568 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -127.97 -40.37 1.7 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.389 0.676 . . . . 0.0 110.062 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.2 -1.77 8.76 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.525 0.33 . . . . 0.0 111.786 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 63.6 mtt180 -130.84 -3.0 4.1 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 123.022 0.529 . . . . 0.0 111.926 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.47 ' C ' ' H ' ' A' ' 93' ' ' ARG . 73.6 mt -136.35 14.59 3.24 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.362 0.528 . . . . 0.0 111.51 -172.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.79 18.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.424 1.09 . . . . 0.0 112.124 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.47 ' H ' ' C ' ' A' ' 91' ' ' LEU . 85.2 mmt-85 -126.34 11.28 7.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.373 0.669 . . . . 0.0 112.064 -174.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 20.4 ptp -122.78 164.5 18.24 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 117.921 0.328 . . . . 0.0 110.304 175.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.41 ' C ' ' H ' ' A' ' 97' ' ' LEU . 63.5 m -62.45 143.29 96.09 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 123.258 0.623 . . . . 0.0 110.286 -176.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -53.06 -0.62 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 124.95 3.767 . . . . 0.0 115.139 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.41 ' H ' ' C ' ' A' ' 95' ' ' THR . 31.1 tp -119.47 -19.44 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.406 0.548 . . . . 0.0 110.564 -179.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.6 m -69.1 -27.72 65.85 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 mtp-105 -69.9 -26.79 64.33 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.525 0.33 . . . . 0.0 110.16 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -81.06 -39.34 25.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.13 -34.36 77.88 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.15 -49.26 68.03 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.557 0.343 . . . . 0.0 110.812 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.71 -4.65 35.8 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.7 tp -106.64 -4.44 19.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.817 0.447 . . . . 0.0 111.772 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 72.8 p -140.11 5.02 2.08 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.9 -1.06 6.61 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.587 0.631 . . . . 0.0 112.541 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 8.3 ptp -150.71 12.27 0.69 Allowed 'General case' 0 C--N 1.338 0.091 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -179.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -143.75 -12.26 0.67 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.723 0.692 . . . . 0.0 111.995 176.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 67.2 15.07 64.92 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.994 -0.892 . . . . 0.0 114.135 173.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -60.93 146.68 45.91 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.844 1.322 . . . . 0.0 110.231 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.7 m -65.98 153.51 91.46 Favored Pre-proline 0 N--CA 1.454 -0.24 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.51 -17.26 43.56 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.555 2.17 . . . . 0.0 111.24 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -74.93 -34.39 62.1 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 117.847 0.294 . . . . 0.0 110.711 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -82.26 -34.54 28.73 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.0 -27.48 67.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.437 0.295 . . . . 0.0 110.698 175.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.71 -32.91 53.23 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.46 -23.53 62.71 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.397 0.679 . . . . 0.0 111.213 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -88.82 -5.32 58.12 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 16.9 pt -135.13 12.07 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 O-C-N 121.875 -0.515 . . . . 0.0 111.071 176.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 54.42 58.22 5.12 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.898 1.279 . . . . 0.0 113.566 176.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.47 -178.71 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.807 0.843 . . . . 0.0 109.816 176.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -83.96 160.79 20.98 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.3 m -58.67 -36.96 74.99 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 122.018 -0.427 . . . . 0.0 110.912 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 97.6 p -72.66 -20.93 61.16 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -76.27 -33.38 59.12 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 121.97 -0.456 . . . . 0.0 110.084 178.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.9 t -66.22 -37.56 79.98 Favored 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.69 -32.19 73.22 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.444 0.164 . . . . 0.0 110.858 177.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.4 m -76.1 -39.43 55.27 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.515 177.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.44 -33.78 76.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.224 -0.417 . . . . 0.0 111.456 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.2 m -78.5 -26.44 13.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.138 0 CA-C-N 118.765 0.711 . . . . 0.0 111.12 177.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 60.7 m -68.45 -40.08 81.22 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.1 -27.42 60.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.8 -48.68 36.0 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 122.473 -0.142 . . . . 0.0 110.653 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 117.909 0.322 . . . . 0.0 111.731 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.82 -41.0 62.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 174.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -72.35 -22.24 61.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 119.513 -0.279 . . . . 0.0 110.461 178.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.7 mm -75.29 -44.3 42.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.514 0.597 . . . . 0.0 109.745 176.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -69.51 -20.48 63.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -94.7 -8.02 38.99 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -172.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -155.29 -12.06 0.11 Allowed 'General case' 0 C--N 1.34 0.193 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -175.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 41.1 p . . . . . 0 N--CA 1.467 0.387 0 CA-C-N 119.941 1.246 . . . . 0.0 112.354 -178.804 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 CA--C 1.532 0.278 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.7 tpt -58.5 -26.6 63.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -70.43 -34.24 68.28 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.8 -22.16 43.41 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 117.285 0.543 . . . . 0.0 110.541 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.98 71.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.816 0.341 . . . . 0.0 110.099 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 90.7 mt -74.78 -31.62 61.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.219 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -67.72 -37.66 82.53 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 117.94 0.336 . . . . 0.0 110.42 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -65.86 -37.23 85.64 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.833 0.288 . . . . 0.0 110.499 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.74 -29.12 68.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -102.23 -14.08 17.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 O-C-N 122.083 -0.386 . . . . 0.0 111.585 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -66.99 -36.76 82.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.78 -31.96 70.16 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.621 0.368 . . . . 0.0 110.791 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 96.1 m -73.68 -8.95 58.02 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.228 0.611 . . . . 0.0 112.327 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.441 ' C ' ' H ' ' B' ' 42' ' ' GLU . 16.7 tt -123.54 -7.18 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 118.77 0.714 . . . . 0.0 111.776 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.11 24.38 0.13 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.406 -0.809 . . . . 0.0 110.714 171.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.441 ' H ' ' C ' ' B' ' 40' ' ' ILE . 81.6 mm-40 -131.94 171.92 12.98 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.485 0.714 . . . . 0.0 111.179 -175.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -67.54 -177.34 0.73 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.399 1.079 . . . . 0.0 112.113 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 35.2 m -132.39 150.36 75.72 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.809 0.844 . . . . 0.0 109.231 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.29 -25.98 5.39 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.169 2.58 . . . . 0.0 113.051 -175.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 51.89 4.07 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.881 1.272 . . . . 0.0 114.015 -176.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -66.0 -22.12 66.44 Favored 'General case' 0 CA--C 1.528 0.108 0 O-C-N 121.461 -0.774 . . . . 0.0 111.243 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 27.6 mtm -70.71 -34.2 71.68 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.661 0.384 . . . . 0.0 111.017 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 71.7 mt -82.52 -15.03 53.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.888 -0.507 . . . . 0.0 109.884 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -70.31 -20.49 63.01 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.995 -0.441 . . . . 0.0 109.837 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.03 -14.7 61.47 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.192 -0.318 . . . . 0.0 110.655 173.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.483 ' C ' ' H ' ' B' ' 54' ' ' LYS . 31.1 mt -86.72 -20.93 26.97 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.093 173.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -69.84 16.23 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.705 0.402 . . . . 0.0 111.928 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.483 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -135.04 5.41 3.3 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.724 0.81 . . . . 0.0 111.175 177.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 pp -151.52 -2.73 0.31 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.237 0 CA-C-N 118.426 0.557 . . . . 0.0 110.101 175.983 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.6 tp -60.98 -35.75 77.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 121.974 0.11 . . . . 0.0 111.099 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.85 -29.16 67.63 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.168 -177.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -74.91 0.91 14.1 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.545 0.738 . . . . 0.0 110.251 176.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -137.12 8.37 2.95 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.419 1.088 . . . . 0.0 110.687 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.6 tp -118.31 -38.89 3.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.223 0.609 . . . . 0.0 110.622 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.58 97.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -74.09 -0.22 9.27 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.282 1.988 . . . . 0.0 112.631 -176.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.409 ' CE1' ' HE ' ' A' ' 53' ' ' ARG . 39.1 m-70 -133.67 3.17 3.52 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.017 0.527 . . . . 0.0 111.158 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.2 tp -59.64 -43.49 95.63 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 124.632 1.173 . . . . 0.0 113.786 -177.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -75.0 -10.67 21.32 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.741 1.628 . . . . 0.0 112.367 -176.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-30 -66.57 -22.59 66.14 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.594 0.634 . . . . 0.0 111.365 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -74.05 -17.15 61.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.209 -0.307 . . . . 0.0 110.557 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.7 ttt85 -105.06 -26.25 12.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.763 0.425 . . . . 0.0 111.221 -175.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -61.68 -19.6 62.52 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 122.877 0.471 . . . . 0.0 111.647 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -136.83 -11.88 1.75 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.423 0.289 . . . . 0.0 111.143 175.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.27 -38.64 96.55 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 177.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.9 mtm105 -68.69 -24.9 64.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.105 0.953 . . . . 0.0 110.423 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.42 4.15 36.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.691 0.797 . . . . 0.0 111.253 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 tp -126.74 4.59 6.69 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.979 0.912 . . . . 0.0 110.297 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.3 p -135.81 -9.52 2.1 Favored 'General case' 0 C--N 1.338 0.078 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.76 2.36 44.41 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-O 119.494 -0.615 . . . . 0.0 114.093 173.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 t -157.03 140.08 15.38 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.262 1.031 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -66.54 -20.99 66.16 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.207 177.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -78.81 -32.03 46.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -79.01 -40.24 31.98 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.45 -32.31 83.72 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -71.88 -39.71 69.43 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 117.129 0.465 . . . . 0.0 111.264 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -26.43 30.77 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 120.458 -0.497 . . . . 0.0 112.122 -177.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -69.17 -35.43 76.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 119.097 0.862 . . . . 0.0 110.059 176.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.0 t -65.01 -43.71 96.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.147 0 CA-C-O 120.643 0.259 . . . . 0.0 110.526 176.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.3 ttp-105 -78.76 -28.48 44.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 122.302 -0.249 . . . . 0.0 111.661 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.57 -29.73 65.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 65.0 m -65.15 -37.88 88.82 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.8 -42.72 32.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -177.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -63.41 -24.66 67.94 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.795 -0.565 . . . . 0.0 110.475 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.14 -0.08 26.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.406 0.682 . . . . 0.0 111.528 176.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 92.2 mt -120.24 -15.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.836 0.854 . . . . 0.0 109.696 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.02 -14.37 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.367 0.667 . . . . 0.0 110.775 173.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.85 4.41 9.43 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.679 0.792 . . . . 0.0 110.937 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.28 55.5 1.41 Allowed Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.33 0.652 . . . . 0.0 111.494 -177.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -68.43 -4.72 13.48 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.368 2.045 . . . . 0.0 110.868 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -85.81 4.11 38.53 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.2 1.0 . . . . 0.0 111.662 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -131.26 20.88 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.119 0.418 . . . . 0.0 111.358 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -131.83 53.67 12.09 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.457 0.703 . . . . 0.0 110.073 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.77 171.72 17.67 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.148 3.232 . . . . 0.0 112.752 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.45 ' C ' ' H ' ' A' ' 50' ' ' VAL . 5.1 mpt_? -113.08 18.82 17.72 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.179 1.392 . . . . 0.0 110.126 175.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.09 4.41 0.9 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.989 0.916 . . . . 0.0 110.809 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.45 ' H ' ' C ' ' A' ' 48' ' ' ARG . 30.4 m -135.73 177.75 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 125.462 1.505 . . . . 0.0 108.494 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.411 ' C ' ' H ' ' A' ' 53' ' ' ARG . 14.0 m-20 -57.93 148.47 59.46 Favored Pre-proline 0 C--O 1.232 0.173 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.33 10.69 0.53 Allowed 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.793 2.995 . . . . 0.0 111.666 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.411 ' H ' ' C ' ' A' ' 51' ' ' ASP . 98.9 mtt180 -126.52 -16.67 5.27 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 124.029 0.932 . . . . 0.0 110.613 177.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -45.3 64.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.47 -32.83 82.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.68 -50.08 74.38 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.227 -0.656 . . . . 0.0 109.227 178.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -76.71 -29.64 56.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.572 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -68.14 -42.03 80.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 119.671 -0.204 . . . . 0.0 111.145 -176.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.4 mmm -79.41 -31.31 42.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.994 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -68.02 -38.82 83.01 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.939 0.336 . . . . 0.0 110.212 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 tm0? -70.74 -25.2 62.82 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 122.506 0.322 . . . . 0.0 110.199 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.77 -39.75 85.66 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -72.34 -36.75 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.109 0 CA-C-N 118.194 0.997 . . . . 0.0 109.698 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -68.71 -35.61 77.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.522 -0.111 . . . . 0.0 110.916 -177.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.44 -31.12 66.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 176.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -72.48 -28.01 62.64 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.05 -36.7 58.93 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.384 -0.198 . . . . 0.0 110.549 177.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -73.51 -14.07 61.15 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.298 -0.251 . . . . 0.0 110.488 175.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.18 9.49 39.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.426 0.691 . . . . 0.0 110.458 176.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.3 -8.52 3.35 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.076 0.551 . . . . 0.0 111.056 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 149.91 -22.46 1.14 Allowed Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.311 -0.716 . . . . 0.0 114.708 173.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.07 140.01 58.78 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.424 1.112 . . . . 0.0 110.771 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -174.54 15.65 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.655 0.782 . . . . 0.0 111.516 178.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -84.28 170.91 13.19 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.11 0.481 . . . . 0.0 110.699 -176.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -64.13 152.7 39.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.005 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.7 p -164.33 9.25 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -175.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -63.51 -11.02 20.72 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -169.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.7 p -158.7 167.59 29.12 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.944 0.793 . . . . 0.0 112.05 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -149.31 19.11 0.95 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.135 0.974 . . . . 0.0 110.522 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.29 -171.57 3.87 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.481 0.712 . . . . 0.0 109.918 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -134.02 12.11 3.94 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.802 0.441 . . . . 0.0 111.604 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -163.9 9.56 0.08 OUTLIER Glycine 0 CA--C 1.53 0.97 0 CA-C-O 119.702 -0.499 . . . . 0.0 114.054 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 t -148.0 -0.25 0.61 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.106 0.953 . . . . 0.0 111.71 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -141.95 -36.16 0.43 Allowed 'General case' 0 C--O 1.228 -0.056 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.05 -28.79 69.11 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.06 -32.39 54.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.738 0.304 . . . . 0.0 110.561 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.23 0.09 55.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.42 0.688 . . . . 0.0 112.296 -175.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -132.26 -12.21 3.18 Favored 'General case' 0 C--O 1.227 -0.119 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.3 -3.42 36.61 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 173.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 70.9 mtt85 -122.62 -12.49 8.11 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.75 0.82 . . . . 0.0 111.03 177.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' A' ' 93' ' ' ARG . 3.4 mm? -134.8 36.04 3.1 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.661 1.184 . . . . 0.0 110.085 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.404 ' C ' ' HD2' ' A' ' 93' ' ' ARG . . . -61.19 9.23 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.418 ' H ' ' C ' ' A' ' 91' ' ' LEU . 2.8 mpt_? -130.42 0.42 4.52 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.922 0.783 . . . . 0.0 111.798 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.5 ttm -69.28 144.07 53.69 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.569 0.622 . . . . 0.0 109.797 177.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.416 ' C ' ' H ' ' A' ' 97' ' ' LEU . 24.2 m -67.19 137.47 94.19 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 123.052 0.541 . . . . 0.0 110.74 -178.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.5 2.98 0.07 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 125.133 3.888 . . . . 0.0 115.448 176.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.416 ' H ' ' C ' ' A' ' 95' ' ' THR . 3.1 tm? -128.63 -33.75 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.816 0.735 . . . . 0.0 109.937 -176.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 51.0 m -64.91 -25.42 67.88 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 121.922 -0.486 . . . . 0.0 110.115 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -70.46 -29.56 66.15 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 122.563 0.345 . . . . 0.0 110.413 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -72.71 -37.85 67.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.66 -31.56 68.52 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.082 -0.386 . . . . 0.0 110.173 176.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.49 -47.01 77.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.17 -11.16 60.43 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.712 -0.617 . . . . 0.0 111.544 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 65.2 mt -91.4 -5.1 54.95 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.103 -0.373 . . . . 0.0 111.627 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 68.5 p -135.55 6.32 3.23 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.58 7.91 1.94 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.059 0.544 . . . . 0.0 111.229 177.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.6 mtm -146.61 -2.1 0.67 Allowed 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -176.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -150.18 -17.59 0.25 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.919 0.781 . . . . 0.0 112.17 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 74.4 16.31 79.97 Favored Glycine 0 C--N 1.34 0.784 0 CA-C-O 119.345 -0.697 . . . . 0.0 114.005 173.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -61.27 149.88 36.49 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.639 1.22 . . . . 0.0 110.192 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.8 m -73.73 156.0 88.65 Favored Pre-proline 0 C--O 1.232 0.162 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -53.15 -27.18 36.14 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 123.198 2.598 . . . . 0.0 113.248 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.13 -33.89 70.52 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.938 -0.476 . . . . 0.0 110.798 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -83.53 -35.54 24.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.66 -29.6 67.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.148 0.179 . . . . 0.0 111.351 178.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.18 -32.93 50.32 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.574 0.226 . . . . 0.0 110.662 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -69.11 -30.87 69.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 52.5 mt -75.51 -6.5 50.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 10.1 pt -135.24 11.2 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 118.796 0.725 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 53.78 56.18 7.51 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.857 1.263 . . . . 0.0 113.955 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.4 m -135.98 176.08 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 C-N-CA 123.455 0.702 . . . . 0.0 110.183 175.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -73.31 156.77 38.09 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 120.859 0.362 . . . . 0.0 110.333 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 33.3 m -60.48 -35.9 77.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 121.95 -0.469 . . . . 0.0 110.978 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 89.5 p -75.54 -21.3 58.05 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.976 -0.453 . . . . 0.0 111.512 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -74.44 -43.13 57.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.365 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.7 p -67.25 -29.6 46.41 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.221 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.38 -33.86 76.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.1 m -75.94 -36.23 59.43 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.4 -35.1 79.48 Favored 'General case' 0 CA--C 1.527 0.094 0 O-C-N 122.195 -0.315 . . . . 0.0 111.546 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.7 m -79.15 -26.59 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 118.442 0.564 . . . . 0.0 111.02 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 51.9 m -67.13 -35.49 79.85 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -81.01 -25.06 37.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.478 -0.139 . . . . 0.0 110.873 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.83 -43.6 68.22 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 122.189 -0.319 . . . . 0.0 110.229 179.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -74.84 -22.23 58.81 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.177 0.191 . . . . 0.0 110.748 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.37 -34.84 73.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -75.73 -22.89 56.13 Favored 'General case' 0 N--CA 1.457 -0.116 0 O-C-N 122.289 -0.257 . . . . 0.0 110.54 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.0 mm -73.49 -52.52 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.148 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -69.83 -20.5 63.43 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -175.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -72.02 -20.69 61.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -154.06 -37.82 0.1 Allowed 'General case' 0 N--CA 1.458 -0.067 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -173.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 56.4 p . . . . . 0 N--CA 1.467 0.406 0 C-N-CA 126.274 1.83 . . . . 0.0 115.796 -168.186 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 110.882 -0.044 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.1 tpt -54.13 -35.06 61.79 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.18 -37.19 94.11 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.97 -15.6 58.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.36 -0.494 . . . . 0.0 111.254 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.3 -58.11 3.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . 0.407 ' H ' ' CD2' ' B' ' 32' ' ' LEU . 1.9 pt? -81.51 -13.25 58.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.489 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -69.5 -35.6 75.69 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.582 0.628 . . . . 0.0 109.408 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 36.4 t -66.54 -35.41 80.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.7 -31.76 72.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 110.923 175.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -87.39 -20.86 26.09 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 121.759 -0.588 . . . . 0.0 111.059 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -69.51 -36.03 76.09 Favored 'General case' 0 CA--C 1.526 0.027 0 CA-C-N 118.447 0.567 . . . . 0.0 111.131 -178.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -67.03 -16.69 64.52 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 118.057 0.389 . . . . 0.0 111.115 178.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -79.16 -13.31 59.8 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 110.56 -0.163 . . . . 0.0 110.56 173.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.47 ' C ' ' H ' ' B' ' 42' ' ' GLU . 30.8 mm -102.46 -18.45 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 118.213 0.461 . . . . 0.0 111.052 -178.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -74.88 28.92 0.09 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.596 0.758 . . . . 0.0 110.663 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.47 ' H ' ' C ' ' B' ' 40' ' ' ILE . 80.6 mm-40 -137.67 177.62 7.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.084 0.954 . . . . 0.0 110.794 -174.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -65.82 179.33 0.88 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.889 0.876 . . . . 0.0 111.489 177.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.42 151.52 74.89 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.074 0.55 . . . . 0.0 110.173 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.07 79.15 3.47 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.091 3.194 . . . . 0.0 110.869 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.43 -3.77 0.49 Allowed 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -61.25 -23.77 65.89 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.766 -0.584 . . . . 0.0 112.179 179.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -69.26 -33.63 73.54 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 118.268 0.485 . . . . 0.0 110.211 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 78.7 mt -83.51 -13.03 55.51 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.89 -0.506 . . . . 0.0 110.561 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -71.12 -23.47 62.1 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.58 -17.89 61.13 Favored 'General case' 0 CA--C 1.523 -0.072 0 C-N-CA 122.741 0.417 . . . . 0.0 110.804 174.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.485 ' C ' ' H ' ' B' ' 54' ' ' LYS . 37.2 mt -90.59 -14.76 31.85 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.317 -0.24 . . . . 0.0 110.889 173.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -72.35 18.54 0.09 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.062 0.945 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.485 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.6 pttt -137.14 6.11 2.82 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.472 1.109 . . . . 0.0 110.978 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -149.31 -18.5 0.28 Allowed 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.254 0 CA-C-N 118.314 0.506 . . . . 0.0 112.02 178.893 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 CA--C 1.528 0.102 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.0 tp -54.92 -33.68 62.41 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.909 0.484 . . . . 0.0 111.755 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.49 -23.92 65.31 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.79 -0.569 . . . . 0.0 112.007 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -81.0 -0.4 39.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.427 0.613 . . . . 0.0 111.177 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -134.37 3.56 3.36 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.403 0.681 . . . . 0.0 110.432 -178.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.06 -41.65 5.31 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.873 0.869 . . . . 0.0 108.952 178.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.84 -43.5 91.85 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.69 -4.46 15.38 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.386 2.057 . . . . 0.0 113.284 -173.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -135.56 12.77 3.47 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.236 0.471 . . . . 0.0 110.801 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -56.03 -41.05 89.02 Favored Pre-proline 0 CA--C 1.537 0.474 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.49 -8.28 12.62 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 121.954 1.77 . . . . 0.0 112.466 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.92 -21.42 65.99 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.855 0.752 . . . . 0.0 110.834 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 63.4 mt -73.09 -18.98 61.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.795 0.27 . . . . 0.0 110.487 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.9 mtt-85 -97.93 -19.75 17.88 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -53.6 -27.24 25.59 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.88 1.272 . . . . 0.0 111.833 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.8 p90 -140.44 -14.86 0.97 Allowed 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.681 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.5 -29.73 75.93 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -70.77 -3.68 20.01 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.23 1.015 . . . . 0.0 112.037 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.32 6.36 7.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.631 0.772 . . . . 0.0 110.398 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.4 tp -107.96 6.63 27.37 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.293 1.037 . . . . 0.0 110.103 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.8 p -132.87 -19.28 2.31 Favored 'General case' 0 C--O 1.23 0.047 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.28 -2.84 87.39 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-O 119.672 -0.515 . . . . 0.0 112.712 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.6 t -157.92 139.26 13.54 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.214 1.007 . . . . 0.0 110.858 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -65.23 -20.1 66.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.42 -0.175 . . . . 0.0 111.184 178.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -72.99 -34.56 66.49 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 178.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -83.18 -29.02 28.91 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.226 -0.286 . . . . 0.0 110.226 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.52 -40.98 67.05 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.67 -33.67 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 117.434 0.617 . . . . 0.0 110.684 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -69.72 -45.92 67.11 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 119.469 -0.301 . . . . 0.0 111.448 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -67.65 -32.58 73.36 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.453 0.57 . . . . 0.0 111.248 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.6 t -63.94 -50.15 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 CA-C-N 118.173 0.442 . . . . 0.0 110.673 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -75.74 -27.38 58.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.974 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.8 -23.03 59.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.741 -0.171 . . . . 0.0 110.828 176.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.0 m -63.57 -48.0 79.21 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.58 -35.26 72.95 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.73 0.3 . . . . 0.0 110.333 -178.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -67.12 -16.66 64.46 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.876 -0.515 . . . . 0.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -87.39 -6.88 58.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.956 -0.465 . . . . 0.0 111.281 174.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 36.2 mm -98.36 -27.59 3.68 Favored 'Isoleucine or valine' 0 C--N 1.339 0.122 0 CA-C-N 117.856 0.298 . . . . 0.0 110.682 -179.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.0 m -66.69 -7.09 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -89.81 -15.83 31.48 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 118.077 0.399 . . . . 0.0 110.559 175.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -170.04 89.67 0.53 Allowed Pre-proline 0 CA--C 1.532 0.273 0 C-N-CA 124.199 1.0 . . . . 0.0 109.2 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.48 -5.97 15.35 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.029 2.486 . . . . 0.0 112.219 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.6 -14.51 59.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.497 0.319 . . . . 0.0 110.623 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -83.87 9.35 12.29 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.273 0.629 . . . . 0.0 111.352 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -130.54 79.97 71.13 Favored Pre-proline 0 N--CA 1.451 -0.412 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.43 157.59 61.17 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.303 2.669 . . . . 0.0 111.408 -173.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 7.46 2.77 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.256 1.022 . . . . 0.0 110.493 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.7 9.49 1.8 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.623 1.169 . . . . 0.0 110.835 174.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.2 m -131.77 -172.43 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 C-N-CA 124.509 1.123 . . . . 0.0 109.272 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.407 ' C ' ' H ' ' A' ' 53' ' ' ARG . 5.2 m-20 -58.43 148.98 62.55 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.26 13.19 0.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 124.169 3.246 . . . . 0.0 112.372 -177.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.407 ' H ' ' C ' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -129.11 -16.95 3.95 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 119.312 -0.375 . . . . 0.0 111.371 175.707 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 18.4 mt -71.56 -39.03 70.91 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.649 0.659 . . . . 0.0 110.479 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.2 -39.02 94.34 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -54.3 47.77 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.541 0.736 . . . . 0.0 110.147 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -72.3 -36.29 68.89 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.81 -175.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 52.9 tpt85 -60.77 -41.84 96.31 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.617 0.644 . . . . 0.0 111.394 -174.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.8 mmm -81.38 -26.8 35.19 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.521 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -68.17 -38.0 81.59 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.686 0.676 . . . . 0.0 110.323 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -67.75 -24.79 65.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.47 0.308 . . . . 0.0 110.242 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.22 -37.89 71.81 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -72.25 -40.04 64.97 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 CA-C-N 117.985 0.892 . . . . 0.0 109.999 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -69.14 -35.58 76.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 122.555 -0.091 . . . . 0.0 110.825 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.86 -27.69 65.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 122.387 -0.196 . . . . 0.0 110.689 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.1 t -82.72 -18.14 41.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.286 0.234 . . . . 0.0 110.703 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -46.75 30.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.327 0.251 . . . . 0.0 110.823 -179.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -77.41 -15.89 59.11 Favored 'General case' 0 CA--C 1.527 0.09 0 O-C-N 122.276 -0.265 . . . . 0.0 111.211 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.71 2.03 24.26 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.412 0.685 . . . . 0.0 111.237 176.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -137.75 0.9 2.27 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.089 0.556 . . . . 0.0 111.362 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 87.41 5.94 78.48 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 119.728 -0.484 . . . . 0.0 113.327 175.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.65 -15.41 63.51 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.155 0.978 . . . . 0.0 111.405 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -160.11 153.77 22.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.726 0.81 . . . . 0.0 109.75 177.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -146.33 -9.4 0.5 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.699 0.4 . . . . 0.0 112.046 177.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -165.84 176.85 7.58 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.397 0.679 . . . . 0.0 109.681 -178.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.4 p -152.65 155.91 38.22 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.772 0.429 . . . . 0.0 110.464 177.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -157.26 162.28 39.2 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.8 m -139.0 165.54 26.86 Favored 'General case' 0 C--O 1.23 0.055 0 O-C-N 122.084 -0.385 . . . . 0.0 110.79 -177.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -149.34 25.92 0.87 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.879 0.472 . . . . 0.0 110.994 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.07 164.88 1.47 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.983 0.42 . . . . 0.0 111.307 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.97 -10.65 30.95 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -174.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 157.04 21.74 0.03 OUTLIER Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.255 -0.747 . . . . 0.0 113.437 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.5 t -137.51 6.73 2.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.423 1.111 . . . . 0.0 112.955 -175.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -143.03 -35.89 0.39 Allowed 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.709 0.403 . . . . 0.0 110.043 173.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.44 -27.06 67.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.8 p -66.56 -27.62 40.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 C-N-CA 122.536 0.334 . . . . 0.0 110.422 178.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.66 -0.45 55.17 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.013 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -130.29 -18.52 3.24 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 118.149 0.431 . . . . 0.0 112.087 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.1 -1.82 31.09 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.766 0.426 . . . . 0.0 110.543 174.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -130.24 -13.49 3.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.004 0.522 . . . . 0.0 112.317 -177.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.485 ' C ' ' H ' ' A' ' 93' ' ' ARG . 9.9 mp -129.68 15.51 5.92 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.481 0.713 . . . . 0.0 111.611 -172.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.33 9.51 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 177.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 91' ' ' LEU . 66.9 mtt85 -124.6 15.34 8.8 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.545 0.738 . . . . 0.0 110.892 -176.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 39.3 ttm -115.35 142.38 46.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.028 0.931 . . . . 0.0 109.467 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 98' ' ' SER . 5.7 t -68.04 140.42 93.49 Favored Pre-proline 0 CA--C 1.531 0.22 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -53.2 -22.73 20.63 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.968 3.112 . . . . 0.0 114.418 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -79.3 -46.27 18.04 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.031 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.478 ' H ' HG23 ' A' ' 95' ' ' THR . 55.6 m -67.81 -23.54 65.2 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.214 -0.304 . . . . 0.0 111.175 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.0 ttp180 -67.73 -33.32 74.63 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.22 -37.49 61.09 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 177.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.85 76.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 178.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.1 tp -61.78 -50.92 70.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.547 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 3.8 pp -79.44 0.88 27.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.8 tp -97.29 -6.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.231 -0.293 . . . . 0.0 111.391 177.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.8 p -140.53 -16.78 0.9 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -81.53 -12.89 58.66 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.465 1.03 . . . . 0.0 113.045 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.547 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 1.8 pmm? -154.08 14.9 0.47 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -129.58 -11.99 4.42 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.525 0.602 . . . . 0.0 112.052 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 68.51 7.55 53.57 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-O 118.887 -0.951 . . . . 0.0 114.761 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -58.39 150.34 22.52 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.354 1.577 . . . . 0.0 110.634 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.9 p -71.8 161.28 79.54 Favored Pre-proline 0 N--CA 1.454 -0.269 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.48 -16.49 47.5 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.059 1.84 . . . . 0.0 111.02 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -79.17 -45.05 20.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 117.884 0.311 . . . . 0.0 110.572 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -74.07 -32.0 63.08 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.54 -22.67 63.54 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.239 0.216 . . . . 0.0 110.991 177.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.11 -29.79 34.75 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.516 0.198 . . . . 0.0 110.694 179.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.3 -38.94 82.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.663 0.385 . . . . 0.0 111.333 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 57.0 mt -72.91 -4.06 29.61 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 12.5 pt -135.41 11.64 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 118.986 0.812 . . . . 0.0 111.281 177.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 52.03 59.57 4.44 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.905 1.282 . . . . 0.0 113.827 176.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.03 -178.42 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 123.521 0.728 . . . . 0.0 109.932 176.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -83.28 160.26 21.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 86.2 m -60.49 -37.56 81.49 Favored 'General case' 0 C--O 1.232 0.177 0 O-C-N 121.954 -0.466 . . . . 0.0 110.579 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.9 t -70.5 -24.51 62.86 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 122.364 -0.21 . . . . 0.0 111.029 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -71.68 -37.53 70.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.126 178.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.05 -38.63 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-N 118.401 0.546 . . . . 0.0 109.842 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -58.78 -37.86 77.26 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 110.508 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.7 m -78.05 -38.4 44.54 Favored 'General case' 0 N--CA 1.457 -0.085 0 O-C-N 122.432 -0.167 . . . . 0.0 110.656 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 60.3 mt -64.85 -33.35 75.79 Favored 'General case' 0 N--CA 1.456 -0.139 0 O-C-N 122.082 -0.386 . . . . 0.0 111.672 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.3 m -80.56 -28.68 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 CA-C-N 118.587 0.631 . . . . 0.0 110.521 177.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 89.5 m -68.58 -38.2 80.5 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -76.72 -27.62 55.51 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.267 -0.271 . . . . 0.0 110.888 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.67 -49.85 55.74 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 122.23 -0.294 . . . . 0.0 110.309 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.02 -22.34 62.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.716 -0.183 . . . . 0.0 111.131 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.91 -37.18 64.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.746 0.248 . . . . 0.0 110.726 177.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -74.45 -19.35 60.42 Favored 'General case' 0 N--CA 1.457 -0.079 0 CA-C-N 117.599 0.182 . . . . 0.0 110.544 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 19.2 mm -75.11 -56.39 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.79 -16.64 64.21 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -70.71 -22.29 62.46 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 179.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -157.57 -38.15 0.07 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -173.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 30.3 p . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 124.504 1.121 . . . . 0.0 112.274 -169.483 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.532 0.27 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -60.83 -27.0 67.75 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.302 0.501 . . . . 0.0 111.492 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.35 -33.69 61.32 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.669 -0.973 . . . . 0.0 110.669 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.49 -23.02 37.63 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 117.163 0.482 . . . . 0.0 110.841 179.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.05 -43.02 72.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.25 -39.34 75.05 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.112 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.93 -35.29 78.19 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.053 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.1 t -65.81 -42.94 90.05 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.477 0.581 . . . . 0.0 110.214 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.9 66.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.592 0.357 . . . . 0.0 111.81 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -110.77 -14.89 13.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 62.0 tp60 -68.33 -38.19 81.29 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.74 -24.99 67.74 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.211 0.078 . . . . 0.0 111.211 176.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 39.8 m -72.04 -12.59 61.29 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 47.0 pt -129.1 8.36 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 118.403 0.547 . . . . 0.0 111.92 -178.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.56 24.72 0.56 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.26 0.624 . . . . 0.0 111.536 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -144.77 -178.32 5.96 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.859 -0.526 . . . . 0.0 111.622 -176.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -61.91 175.96 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.583 1.153 . . . . 0.0 111.808 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.2 m -135.33 155.88 78.36 Favored Pre-proline 0 C--O 1.232 0.156 0 C-N-CA 122.924 0.49 . . . . 0.0 111.064 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.2 176.24 2.12 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.844 3.03 . . . . 0.0 112.472 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -148.55 -2.39 0.5 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.389 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -65.29 -24.85 67.41 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.681 0.393 . . . . 0.0 111.483 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 45.2 mtm -76.18 -36.7 58.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.403 0.281 . . . . 0.0 110.956 -179.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 64.2 mt -77.72 -15.58 59.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.616 -0.678 . . . . 0.0 109.736 175.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -71.11 -21.33 62.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.829 -0.545 . . . . 0.0 109.698 173.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.0 mt -71.56 -14.61 62.14 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 173.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.469 ' C ' ' H ' ' B' ' 54' ' ' LYS . 28.5 mt -89.73 -16.47 30.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.747 0.249 . . . . 0.0 111.48 174.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -71.09 18.35 0.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.469 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.8 pttt -133.91 2.7 3.41 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.31 0.644 . . . . 0.0 111.918 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -153.04 -3.3 0.22 Allowed 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.234 0 CA-C-N 118.751 0.705 . . . . 0.0 112.096 -178.413 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.2 p . . . . . 0 CA--C 1.527 0.093 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.1 tp -85.27 -31.73 22.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 117.997 0.362 . . . . 0.0 111.04 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.83 -30.62 74.54 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -73.11 2.18 7.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.903 0.881 . . . . 0.0 111.269 177.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -130.66 -20.37 2.9 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.461 0.704 . . . . 0.0 111.043 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.53 -32.51 18.15 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.568 0.347 . . . . 0.0 111.313 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.413 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.79 -44.28 96.83 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 72.2 Cg_endo -71.89 -2.32 11.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.098 1.866 . . . . 0.0 112.423 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -135.2 12.73 3.56 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.122 0.569 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 tp -57.82 -41.94 92.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.835 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -76.67 -10.94 18.61 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.592 1.528 . . . . 0.0 112.275 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -70.78 -21.28 62.52 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-N 118.775 0.716 . . . . 0.0 110.814 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.4 mt -70.79 -28.18 64.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.831 0.287 . . . . 0.0 110.984 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ptm85 -105.04 -13.67 15.67 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 122.243 -0.286 . . . . 0.0 110.728 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -52.68 -25.81 12.02 Favored 'General case' 0 C--N 1.338 0.071 0 C-N-CA 123.911 0.884 . . . . 0.0 110.845 175.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -139.99 -10.1 1.15 Allowed 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 123.102 0.251 . . . . 0.0 111.576 175.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.0 -28.47 63.73 Favored Glycine 0 C--N 1.34 0.76 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 173.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.34 -8.4 39.61 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.199 0.6 . . . . 0.0 111.837 175.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -116.73 0.37 12.56 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.103 0.561 . . . . 0.0 111.622 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -97.61 -3.53 39.36 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.062 0.545 . . . . 0.0 111.379 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -156.59 -5.65 0.11 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.58 26.06 51.77 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 121.891 -0.506 . . . . 0.0 113.778 174.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 t -150.92 127.45 10.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.798 0.799 . . . . 0.0 109.553 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -71.82 -18.66 62.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.112 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -68.32 -42.67 79.04 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -81.17 -31.72 33.92 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 177.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.52 -42.54 93.57 Favored Glycine 0 C--N 1.335 0.515 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -72.51 -30.23 64.3 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 117.595 0.697 . . . . 0.0 110.148 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -71.09 -41.82 70.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.411 -0.328 . . . . 0.0 111.487 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -66.07 -44.21 85.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.412 0.551 . . . . 0.0 111.598 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.7 m -68.52 -34.72 66.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 CA-C-N 118.499 0.59 . . . . 0.0 110.97 -176.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.9 ttp180 -79.45 -32.45 42.68 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.094 -0.379 . . . . 0.0 110.825 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.61 63.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 64.5 m -64.61 -40.38 95.39 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.62 -34.98 53.16 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -61.67 -24.27 66.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.96 -0.462 . . . . 0.0 110.411 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.15 -16.17 59.24 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.593 0.357 . . . . 0.0 111.04 175.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 20.3 mm -90.57 -18.92 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 58.7 t -64.52 -4.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.277 0.631 . . . . 0.0 110.968 176.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.47 1.68 9.57 Favored 'General case' 0 C--N 1.34 0.177 0 O-C-N 121.697 -0.627 . . . . 0.0 111.195 178.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -158.16 54.35 0.74 Allowed Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 123.239 0.616 . . . . 0.0 111.094 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -72.08 -3.71 13.79 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.981 3.121 . . . . 0.0 112.034 -176.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -106.01 12.59 30.3 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.268 0.627 . . . . 0.0 112.131 -175.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -138.67 7.92 2.56 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -56.15 132.13 74.88 Favored Pre-proline 0 CA--C 1.531 0.237 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -69.97 120.94 7.6 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.346 2.697 . . . . 0.0 112.038 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.4 mmm180 -142.14 6.17 1.73 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.96 1.304 . . . . 0.0 110.205 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -82.53 13.3 3.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.117 0.967 . . . . 0.0 111.068 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.65 -166.73 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 125.03 1.332 . . . . 0.0 108.654 -177.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.54 144.09 18.35 Favored Pre-proline 0 N--CA 1.455 -0.195 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -65.87 2.02 1.96 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.899 2.399 . . . . 0.0 112.259 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -121.64 -18.35 7.19 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 123.616 0.766 . . . . 0.0 111.162 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -74.34 -31.21 62.34 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.262 0.483 . . . . 0.0 110.325 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.46 -33.99 68.05 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.74 -44.54 95.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -80.5 -19.87 44.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.315 -0.374 . . . . 0.0 111.782 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 24.3 tpt180 -70.48 -47.31 61.17 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.643 0.656 . . . . 0.0 110.548 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -71.34 -33.7 69.84 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.098 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -66.72 -39.85 88.16 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.288 -0.258 . . . . 0.0 111.314 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -68.41 -24.72 64.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.75 -37.57 84.48 Favored Glycine 0 C--N 1.339 0.717 0 N-CA-C 111.394 -0.683 . . . . 0.0 111.394 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.2 mm -73.48 -41.6 56.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.127 0 CA-C-N 117.84 0.82 . . . . 0.0 110.166 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.4 t90 -67.54 -38.17 83.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.713 0.233 . . . . 0.0 110.934 -176.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.05 -29.0 62.65 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.241 -0.287 . . . . 0.0 111.108 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 40.2 t -80.08 -30.68 39.27 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 117.539 0.154 . . . . 0.0 110.938 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.77 -31.0 59.33 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.411 -0.181 . . . . 0.0 111.182 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -85.33 -12.45 52.23 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 122.172 -0.33 . . . . 0.0 111.335 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.23 0.03 26.74 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -140.34 4.51 2.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.665 0.386 . . . . 0.0 111.362 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.13 6.21 88.33 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.941 -0.366 . . . . 0.0 112.809 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -75.59 5.14 6.41 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 117.664 0.732 . . . . 0.0 111.807 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -150.78 172.2 15.98 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.077 0.465 . . . . 0.0 111.131 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -146.66 -167.13 2.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.06 1.344 . . . . 0.0 108.729 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 10.4 t -138.9 164.17 30.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.993 0.517 . . . . 0.0 110.03 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.0 t -158.43 -172.72 3.97 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.398 0.679 . . . . 0.0 109.774 -176.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -148.58 8.55 0.79 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.5 m -146.14 142.13 28.18 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.896 0.771 . . . . 0.0 111.499 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -154.13 10.91 0.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.313 1.045 . . . . 0.0 110.403 175.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -153.81 -174.89 5.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.622 0.769 . . . . 0.0 109.582 -176.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -126.17 11.25 7.56 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.106 0.562 . . . . 0.0 110.764 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -166.18 9.71 0.06 OUTLIER Glycine 0 CA--C 1.527 0.843 0 CA-C-O 119.23 -0.761 . . . . 0.0 112.653 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.2 p -139.68 -7.58 1.27 Allowed 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.567 1.184 . . . . 0.0 112.917 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -137.93 -39.18 0.56 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.75 -25.41 67.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.9 p -66.66 -31.02 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 C-N-CA 122.542 0.337 . . . . 0.0 110.565 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.2 -1.08 52.13 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.223 0.609 . . . . 0.0 111.568 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -130.55 -15.07 3.61 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.49 0.316 . . . . 0.0 111.698 177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.92 -1.93 18.84 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.871 0.468 . . . . 0.0 110.468 174.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -129.25 -15.64 4.11 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.994 0.518 . . . . 0.0 111.536 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.443 ' C ' ' H ' ' A' ' 93' ' ' ARG . 3.5 mm? -138.02 36.44 2.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.114 0.966 . . . . 0.0 110.59 -172.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.88 7.77 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.443 ' H ' ' C ' ' A' ' 91' ' ' LEU . 82.3 mmt-85 -130.68 4.35 4.59 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.062 0.846 . . . . 0.0 112.361 -177.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 57.2 ttm -65.79 143.69 57.34 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.369 0.531 . . . . 0.0 111.168 -178.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 m -61.37 139.12 94.82 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.926 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -66.62 5.45 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 124.246 3.297 . . . . 0.0 113.564 -177.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.97 -35.03 2.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.5 m -62.42 -19.65 63.69 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.0 -0.437 . . . . 0.0 109.86 171.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -58.26 -41.34 84.06 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.664 0.786 . . . . 0.0 110.72 174.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -77.47 -38.49 49.17 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.73 74.43 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 122.243 -0.286 . . . . 0.0 110.825 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -66.56 -48.65 68.97 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.3 mt -67.93 -14.95 63.37 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.882 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.0 mt -98.72 -4.82 32.73 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.911 0.484 . . . . 0.0 111.909 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -136.27 10.24 3.24 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.99 4.94 2.31 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.9 mtm -140.8 -5.02 1.18 Allowed 'General case' 0 C--N 1.339 0.109 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -150.25 -5.88 0.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.382 0.992 . . . . 0.0 112.987 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.95 25.25 65.77 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-O 119.009 -0.884 . . . . 0.0 113.828 175.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -55.38 150.16 11.99 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.641 1.22 . . . . 0.0 110.08 177.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 69.7 m -68.39 153.26 95.86 Favored Pre-proline 0 CA--C 1.529 0.172 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.78 -28.62 39.09 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 123.188 2.592 . . . . 0.0 112.807 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -72.84 -32.82 65.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.23 -0.293 . . . . 0.0 110.772 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -83.52 -36.01 24.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 122.367 -0.208 . . . . 0.0 110.499 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.02 70.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 122.396 -0.19 . . . . 0.0 110.99 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.55 -28.58 33.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.66 0.384 . . . . 0.0 111.252 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -71.34 -27.62 63.5 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.651 0.78 . . . . 0.0 111.59 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.9 mt -85.78 -0.16 54.53 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 20.0 pt -135.42 9.86 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 118.509 0.595 . . . . 0.0 111.575 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 55.34 53.92 9.31 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.498 1.119 . . . . 0.0 113.87 175.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 23.3 m -134.79 174.94 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 C-N-CA 122.895 0.478 . . . . 0.0 110.023 174.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -76.29 158.37 31.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 37.2 m -59.87 -36.61 77.28 Favored 'General case' 0 C--N 1.334 -0.098 0 O-C-N 122.109 -0.37 . . . . 0.0 111.149 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 93.4 p -76.88 -20.92 55.7 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 121.79 -0.569 . . . . 0.0 111.1 -178.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.0 -44.02 55.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.059 178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.07 -31.23 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.238 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -62.4 -35.32 78.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.707 0.23 . . . . 0.0 110.408 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.6 m -75.63 -36.65 60.16 Favored 'General case' 0 N--CA 1.457 -0.097 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 178.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.1 mp -67.37 -36.58 81.65 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 119.263 -0.399 . . . . 0.0 111.191 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.9 m -76.47 -26.09 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.128 0 CA-C-N 118.937 0.789 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 82.5 m -66.59 -35.79 81.06 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -80.85 -26.77 36.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.364 -0.21 . . . . 0.0 110.623 177.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.53 73.1 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.43 -0.169 . . . . 0.0 110.63 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -78.18 -22.33 48.78 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.916 -0.49 . . . . 0.0 110.333 177.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.82 -38.71 70.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.214 -0.304 . . . . 0.0 110.466 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -78.85 -18.83 53.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.349 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 5.6 mm -63.68 -51.16 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.12 -17.04 61.44 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -71.89 -17.67 62.1 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -149.82 -41.98 0.14 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 N--CA 1.469 0.484 0 N-CA-C 117.367 2.358 . . . . 0.0 117.367 -175.297 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 . . . . . 0 CA--C 1.531 0.228 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.3 tpt -62.14 -28.7 69.83 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.108 0.413 . . . . 0.0 110.359 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.98 62.89 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -17.44 62.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.157 0.479 . . . . 0.0 111.103 178.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.98 -41.69 20.4 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 20.0 mt -70.82 -37.76 73.24 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.64 -29.14 69.1 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.357 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t -67.29 -40.39 86.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.746 0.703 . . . . 0.0 110.277 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.75 -24.23 64.42 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -105.55 -12.49 15.94 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -72.38 -37.99 68.59 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -65.33 -21.86 66.75 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.804 -0.141 . . . . 0.0 110.789 177.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 60.8 m -73.89 -13.23 60.88 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 117.628 0.195 . . . . 0.0 111.282 174.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 63.6 mt -98.26 -23.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 O-C-N 121.933 -0.479 . . . . 0.0 109.934 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.78 27.2 0.18 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.757 0.823 . . . . 0.0 112.103 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -139.57 175.9 9.18 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -64.68 177.62 0.9 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.193 0.997 . . . . 0.0 112.023 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.11 154.28 77.32 Favored Pre-proline 0 C--O 1.233 0.23 0 C-N-CA 123.774 0.829 . . . . 0.0 109.794 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . 0.408 ' C ' ' H ' ' B' ' 47' ' ' GLU . 91.2 Cg_endo -76.25 -26.59 8.85 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.912 2.408 . . . . 0.0 113.341 -175.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p30 45.15 0.98 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.254 2.222 . . . . 0.0 116.599 -177.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.408 ' H ' ' C ' ' B' ' 45' ' ' PRO . 13.7 pt-20 -66.78 -17.06 64.68 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.243 0.929 . . . . 0.0 111.534 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 17.9 mtm -68.33 -42.03 79.93 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.87 -16.32 57.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -67.71 -21.79 65.29 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.834 -0.541 . . . . 0.0 109.819 173.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.73 -28.86 65.04 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 173.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.96 -14.33 60.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 121.266 -0.174 . . . . 0.0 111.442 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -67.68 -1.05 4.6 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.123 0.42 . . . . 0.0 110.34 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -96.27 -10.15 28.61 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.207 0.603 . . . . 0.0 112.164 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -156.28 -1.1 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.181 0 CA-C-N 119.062 0.846 . . . . 0.0 112.74 -178.435 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 t . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.51 -37.49 85.16 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.389 -0.819 . . . . 0.0 110.817 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.19 -28.24 71.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -77.94 1.49 20.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.414 0.686 . . . . 0.0 111.443 179.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -130.2 -3.66 4.43 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.235 0.614 . . . . 0.0 111.71 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.4 mt -111.19 -25.71 9.57 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.519 -0.277 . . . . 0.0 111.157 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.0 -43.96 76.65 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -74.4 -1.37 10.92 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.52 2.147 . . . . 0.0 113.156 -175.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -134.99 12.26 3.61 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.929 0.492 . . . . 0.0 110.637 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.418 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 43.1 tp -64.47 -39.54 42.36 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 124.847 1.259 . . . . 0.0 114.207 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 90.6 Cg_endo -77.9 -26.22 6.9 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 CA-C-N 120.666 1.274 . . . . 0.0 112.436 -172.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -51.52 -38.34 53.69 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.606 0.639 . . . . 0.0 111.981 -173.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.7 mt -67.54 -19.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -112.56 -32.55 6.43 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -73.98 -6.96 50.53 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.268 0.227 . . . . 0.0 111.235 -177.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -136.8 -13.35 1.69 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.728 0.411 . . . . 0.0 110.785 167.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -57.45 -33.57 66.61 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -59.86 -24.2 64.04 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 117.931 0.865 . . . . 0.0 111.848 177.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.76 0.94 57.46 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.254 0.622 . . . . 0.0 110.654 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -120.86 4.83 10.49 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.508 1.123 . . . . 0.0 110.474 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.9 p -139.22 -15.04 1.12 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.65 -2.99 87.64 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.456 -0.635 . . . . 0.0 113.146 177.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.6 t -159.95 136.06 8.71 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.243 1.022 . . . . 0.0 111.099 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -66.2 -19.09 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.37 -0.206 . . . . 0.0 111.344 175.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -75.34 -28.31 59.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 117.92 0.327 . . . . 0.0 110.198 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -78.11 -37.25 46.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.21 -29.99 75.05 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -69.55 -41.74 75.5 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.244 0.522 . . . . 0.0 110.887 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.29 -24.03 27.89 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 118.906 -0.569 . . . . 0.0 112.27 -175.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -72.77 -36.34 67.63 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 119.309 0.959 . . . . 0.0 109.925 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.6 t -64.89 -43.17 96.33 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 CA-C-N 117.856 0.298 . . . . 0.0 110.618 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -77.31 -28.39 53.22 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 121.279 -0.169 . . . . 0.0 111.266 -178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.48 -27.68 58.92 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.228 0.211 . . . . 0.0 110.589 175.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 53.0 m -63.95 -39.24 93.69 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.73 -45.9 56.32 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -58.31 -30.25 66.53 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.79 0.436 . . . . 0.0 111.773 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.56 0.45 22.96 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.794 0.438 . . . . 0.0 111.918 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 73.1 mt -124.72 -13.9 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 C-N-CA 123.909 0.884 . . . . 0.0 110.177 -177.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.0 t -61.48 -14.45 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.312 0.645 . . . . 0.0 111.09 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.76 5.6 9.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.582 0.753 . . . . 0.0 110.562 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.83 51.75 0.77 Allowed Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 123.335 0.654 . . . . 0.0 111.51 -175.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.46 -8.01 19.5 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.176 2.584 . . . . 0.0 111.856 -178.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -82.1 3.37 27.22 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.956 0.902 . . . . 0.0 110.734 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -114.29 9.07 16.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.052 0.541 . . . . 0.0 111.316 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -129.59 64.5 71.86 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 122.285 0.234 . . . . 0.0 110.489 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.91 170.5 15.4 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.923 3.082 . . . . 0.0 111.334 -178.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.462 ' C ' ' H ' ' A' ' 50' ' ' VAL . 31.1 mmm180 -125.62 12.8 8.04 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.934 0.894 . . . . 0.0 110.589 -177.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -73.35 18.78 0.11 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.47 1.108 . . . . 0.0 111.337 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.462 ' H ' ' C ' ' A' ' 48' ' ' ARG . 27.8 m -136.73 178.6 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 124.7 1.2 . . . . 0.0 109.511 -176.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -54.55 149.4 21.32 Favored Pre-proline 0 C--O 1.233 0.209 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.3 5.93 1.7 Allowed 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.144 2.562 . . . . 0.0 111.953 -176.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -128.16 -24.06 3.2 Favored 'General case' 0 C--O 1.228 -0.033 0 C-N-CA 123.764 0.825 . . . . 0.0 111.35 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.9 tp -66.99 -32.41 73.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.333 0.515 . . . . 0.0 110.287 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -72.91 -34.78 58.69 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.51 -43.22 90.78 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -73.97 -34.5 64.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.475 0.176 . . . . 0.0 111.475 -177.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 48.3 tpt85 -72.47 -37.43 68.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -174.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.0 mmm -76.8 -31.98 57.34 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.18 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -67.09 -35.03 78.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 174.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -64.46 -31.03 72.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.531 0.332 . . . . 0.0 110.236 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.02 -43.84 90.0 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.6 mm -72.98 -39.07 57.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 117.353 0.577 . . . . 0.0 110.099 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -68.25 -41.65 80.83 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.41 -0.181 . . . . 0.0 111.132 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.91 -32.64 74.03 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.186 0.448 . . . . 0.0 110.648 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.1 t -70.12 -25.94 63.72 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 117.515 0.143 . . . . 0.0 110.663 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.59 -36.02 17.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.493 0.317 . . . . 0.0 111.668 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.5 -15.81 61.79 Favored 'General case' 0 C--O 1.226 -0.14 0 O-C-N 121.973 -0.454 . . . . 0.0 110.522 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.96 7.6 8.64 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 111.471 177.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -130.79 -5.24 4.05 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.45 -9.9 3.49 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 114.747 0.659 . . . . 0.0 114.747 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -72.84 6.3 2.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.369 1.084 . . . . 0.0 112.489 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.1 24.0 0.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.516 1.126 . . . . 0.0 112.749 -174.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -154.1 168.61 25.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.253 0.621 . . . . 0.0 110.392 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.7 t 43.58 39.83 2.55 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.269 1.427 . . . . 0.0 112.47 -179.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.1 p -132.17 9.52 4.45 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.44 -14.47 61.26 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 85.8 p -163.72 166.32 22.26 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.798 -0.564 . . . . 0.0 111.969 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -146.1 23.19 1.36 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.091 0.957 . . . . 0.0 110.547 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -142.96 -179.35 6.31 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.109 0.564 . . . . 0.0 110.504 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -136.92 14.76 3.09 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.941 0.497 . . . . 0.0 111.51 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.44 -0.61 0.23 Allowed Glycine 0 CA--C 1.527 0.832 0 CA-C-O 119.516 -0.602 . . . . 0.0 114.061 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -152.2 8.56 0.48 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.386 1.093 . . . . 0.0 112.198 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -139.01 -28.98 0.78 Allowed 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.067 0.547 . . . . 0.0 109.99 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.29 67.69 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 174.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 10.5 p -67.03 -28.87 44.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-O 120.696 0.284 . . . . 0.0 110.318 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 0.74 51.78 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.34 0.656 . . . . 0.0 111.89 -177.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.89 -17.83 3.1 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-N 118.121 0.419 . . . . 0.0 111.815 176.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.14 -1.79 24.75 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.586 0.355 . . . . 0.0 110.679 174.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -128.58 -12.22 4.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.621 0.768 . . . . 0.0 111.564 -179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' A' ' 93' ' ' ARG . 10.0 mp -131.15 24.11 4.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.5 1.12 . . . . 0.0 109.856 -174.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.0 7.26 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.384 1.474 . . . . 0.0 114.826 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.418 ' H ' ' C ' ' A' ' 91' ' ' LEU . 17.7 tpt180 -130.32 -0.15 4.55 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.879 0.763 . . . . 0.0 111.677 -177.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.3 ttm -67.09 147.67 52.86 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 122.079 -0.388 . . . . 0.0 110.514 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.1 m -65.85 140.74 97.36 Favored Pre-proline 0 CA--C 1.531 0.236 0 C-N-CA 123.444 0.698 . . . . 0.0 110.594 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -53.63 2.89 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.474 1 C-N-CA 125.475 4.117 . . . . 0.0 116.313 177.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.2 tp -133.18 -20.03 2.17 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 119.056 0.844 . . . . 0.0 111.586 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.9 m -70.2 -19.4 63.17 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 122.051 -0.405 . . . . 0.0 110.919 176.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -65.47 -45.21 84.59 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.437 0.295 . . . . 0.0 110.973 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -83.26 -25.8 31.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.991 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.62 79.42 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.366 0.53 . . . . 0.0 109.785 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 tp -67.74 -37.59 82.38 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.994 0.518 . . . . 0.0 109.91 177.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.424 ' HA ' ' HE3' ' A' ' 107' ' ' MET . 57.3 tp -66.27 -21.34 66.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 122.562 0.345 . . . . 0.0 110.729 177.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.413 ' CD1' ' HB2' ' A' ' 110' ' ' PHE . 0.2 OUTLIER -90.96 -14.98 30.52 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.207 0.603 . . . . 0.0 111.778 -177.38 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.9 p -134.49 4.86 3.42 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -173.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -123.68 -6.98 7.99 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 118.532 0.605 . . . . 0.0 110.771 174.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.424 ' HE3' ' HA ' ' A' ' 103' ' ' LEU . 21.7 mtm -143.25 0.6 1.18 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -175.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -135.48 -19.96 1.62 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.157 0.435 . . . . 0.0 111.786 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 59.97 17.41 43.8 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 119.118 -0.823 . . . . 0.0 114.501 172.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . 0.413 ' HB2' ' CD1' ' A' ' 104' ' ' LEU . 16.7 m-30 -68.67 162.32 26.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.119 1.46 . . . . 0.0 109.716 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 41.4 t -66.1 145.91 99.01 Favored Pre-proline 0 N--CA 1.456 -0.155 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 175.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.27 -20.39 14.76 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 122.893 2.395 . . . . 0.0 112.656 174.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.2 -31.13 65.6 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 122.44 0.296 . . . . 0.0 111.05 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -80.78 -36.31 31.98 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -66.23 -32.93 74.65 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.662 0.385 . . . . 0.0 110.517 175.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -72.46 -32.45 66.27 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 122.33 0.252 . . . . 0.0 110.823 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -73.76 -22.9 59.7 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 110.758 176.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 28.2 tp -84.26 -9.95 58.07 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -177.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.7 pt -135.25 11.75 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.386 0.539 . . . . 0.0 111.351 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 53.52 59.56 4.27 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.65 1.18 . . . . 0.0 113.96 176.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.4 m -137.77 -179.83 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 C-N-CA 123.683 0.793 . . . . 0.0 109.67 175.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -79.58 156.31 27.76 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.5 m -59.17 -37.27 76.96 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 122.141 -0.349 . . . . 0.0 110.77 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.3 t -72.58 -24.49 61.11 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.316 0.247 . . . . 0.0 111.38 -177.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -69.45 -39.76 77.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.726 -0.609 . . . . 0.0 109.794 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.1 t -64.25 -40.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.107 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -58.73 -37.13 75.51 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 122.929 0.143 . . . . 0.0 110.618 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.9 m -77.86 -38.79 45.28 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.2 mt -64.85 -36.06 83.12 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -177.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 32.2 m -82.86 -28.92 8.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.111 0 CA-C-N 118.343 0.52 . . . . 0.0 111.184 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 54.6 m -68.76 -38.98 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 117.843 0.292 . . . . 0.0 110.224 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -75.79 -27.63 58.05 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.597 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.57 -52.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.356 -0.215 . . . . 0.0 110.88 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -71.19 -22.35 62.04 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.41 78.63 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 175.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -74.94 -18.65 60.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.57 -0.252 . . . . 0.0 110.837 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 21.9 mm -74.93 -55.54 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 CA-C-N 118.371 0.532 . . . . 0.0 109.902 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -19.68 65.79 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.071 0.396 . . . . 0.0 111.793 -176.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.5 -22.07 62.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -162.98 -32.32 0.04 OUTLIER 'General case' 0 C--N 1.34 0.192 0 N-CA-C 115.278 1.585 . . . . 0.0 115.278 -170.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.468 0.431 0 C-N-CA 123.968 0.907 . . . . 0.0 112.163 -170.355 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 . . . . . 0 N--CA 1.456 -0.137 0 CA-C-O 119.693 -0.194 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -66.41 -29.02 69.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.384 0.538 . . . . 0.0 111.207 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.51 -34.74 79.83 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.89 -21.57 65.14 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 122.297 -0.531 . . . . 0.0 110.939 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.88 -36.29 21.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.92 0.391 . . . . 0.0 110.322 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -72.99 -45.82 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.869 0.468 . . . . 0.0 110.733 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.1 tpp85 -73.0 -27.4 61.76 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.002 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 46.8 t -66.52 -36.14 81.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.692 0.678 . . . . 0.0 110.311 177.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.26 -30.05 66.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.125 0.17 . . . . 0.0 110.965 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -91.29 -25.45 19.44 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 122.045 -0.41 . . . . 0.0 111.686 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -69.19 -37.47 78.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.668 0.667 . . . . 0.0 110.988 -178.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -63.22 -20.19 65.21 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 118.213 0.461 . . . . 0.0 110.677 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 9.4 m -86.72 -3.26 59.03 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.652 0.781 . . . . 0.0 111.207 175.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.445 ' C ' ' H ' ' B' ' 42' ' ' GLU . 81.4 mt -119.9 -8.5 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.619 -0.676 . . . . 0.0 111.366 -175.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -70.32 28.38 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.875 0.87 . . . . 0.0 112.122 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.445 ' H ' ' C ' ' B' ' 40' ' ' ILE . 12.8 pt-20 -142.1 179.2 7.04 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.571 -0.706 . . . . 0.0 111.371 -178.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -59.53 178.02 0.17 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.428 1.091 . . . . 0.0 113.543 -176.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -133.7 158.47 75.44 Favored Pre-proline 0 C--O 1.234 0.244 0 C-N-CA 124.175 0.99 . . . . 0.0 109.725 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -75.11 -179.82 5.39 Favored 'Trans proline' 0 N--CA 1.451 -1.018 0 C-N-CA 122.818 2.345 . . . . 0.0 110.357 176.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -148.43 -2.34 0.51 Allowed 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 177.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -66.15 -21.69 66.34 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 121.69 -0.631 . . . . 0.0 111.945 -177.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -67.09 -45.61 76.76 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.98 -20.25 58.04 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.86 -21.4 66.46 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 122.323 -0.236 . . . . 0.0 110.534 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 64.6 mt -71.09 -26.43 63.05 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.329 -0.232 . . . . 0.0 110.44 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . 0.529 ' C ' ' H ' ' B' ' 54' ' ' LYS . 48.6 mt -74.08 -17.28 60.97 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.954 178.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -69.04 17.94 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.065 0.393 . . . . 0.0 111.324 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' B' ' 52' ' ' LEU . 51.9 mtmt -118.47 -2.39 11.06 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.192 0.997 . . . . 0.0 110.931 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -153.83 -14.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.177 0 CA-C-N 118.353 0.524 . . . . 0.0 111.457 177.338 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t 59.26 170.29 0.07 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.609 1.164 . . . . 0.0 113.215 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp -72.33 -24.79 61.36 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.983 0.913 . . . . 0.0 111.525 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -61.57 -32.03 79.86 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.683 -0.636 . . . . 0.0 112.503 -175.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -75.49 1.44 14.15 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 117.74 0.77 . . . . 0.0 111.852 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -134.09 4.97 3.54 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.559 0.744 . . . . 0.0 110.169 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -111.87 -46.89 3.19 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.813 0.845 . . . . 0.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.405 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -60.37 -43.74 93.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -177.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.405 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 75.0 Cg_endo -73.06 -1.49 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.049 1.832 . . . . 0.0 112.495 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -135.03 7.79 3.45 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.02 0.528 . . . . 0.0 110.524 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 46.4 tp -57.92 -45.15 99.81 Favored Pre-proline 0 N--CA 1.451 -0.397 0 C-N-CA 124.354 1.061 . . . . 0.0 112.904 -178.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.84 -10.18 16.88 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.935 1.757 . . . . 0.0 112.624 -179.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -65.71 -20.13 66.17 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.953 0.797 . . . . 0.0 111.429 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.1 mt -75.97 -19.09 59.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.72 0.236 . . . . 0.0 110.88 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.28 -18.07 15.63 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.464 0.706 . . . . 0.0 109.666 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.07 -18.74 26.77 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 125.115 1.366 . . . . 0.0 111.231 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -140.39 -14.05 1.0 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 172.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.65 -28.22 71.13 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.21 -10.01 13.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.397 0.679 . . . . 0.0 111.812 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.21 6.31 4.92 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.367 0.667 . . . . 0.0 111.473 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 tp -106.22 -3.91 20.78 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.047 0.539 . . . . 0.0 110.342 178.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 t -147.84 -19.92 0.36 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.022 0.529 . . . . 0.0 111.439 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 22.81 78.67 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.566 -0.574 . . . . 0.0 113.849 172.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.8 t -146.06 134.77 22.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 118.227 1.014 . . . . 0.0 110.204 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -72.14 -26.49 62.12 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.71 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -73.43 -34.04 65.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -77.05 -39.76 48.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 177.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.23 -36.61 92.0 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -72.02 -36.5 69.69 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.667 0.734 . . . . 0.0 111.246 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -22.91 36.57 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.403 -178.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.94 -44.49 63.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.709 0.686 . . . . 0.0 110.357 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.36 -34.69 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-N 118.549 0.613 . . . . 0.0 110.967 -178.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.54 -32.08 47.77 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.937 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.76 -26.71 60.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 175.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 67.4 m -67.01 -37.57 84.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -43.92 44.23 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -62.67 -25.55 68.2 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.96 -0.463 . . . . 0.0 110.571 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.28 0.19 23.05 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.223 0.609 . . . . 0.0 111.648 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.03 -14.31 7.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.41 0.684 . . . . 0.0 109.99 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 38.2 t -58.3 -14.56 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 123.452 0.701 . . . . 0.0 111.527 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.06 2.28 9.28 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.053 0.541 . . . . 0.0 111.53 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.83 54.56 1.05 Allowed Pre-proline 0 CA--C 1.533 0.304 0 C-N-CA 123.008 0.523 . . . . 0.0 111.28 -177.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.08 -10.99 27.74 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.886 2.391 . . . . 0.0 112.479 -177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.97 -9.64 58.83 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.773 0.429 . . . . 0.0 110.906 176.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -96.93 7.21 47.14 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.4 0.68 . . . . 0.0 111.037 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -129.8 60.63 53.04 Favored Pre-proline 0 CA--C 1.533 0.293 0 C-N-CA 122.666 0.386 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.43 ' C ' ' HD3' ' A' ' 48' ' ' ARG . 92.3 Cg_endo -73.7 163.39 37.41 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.785 2.99 . . . . 0.0 111.109 178.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.43 ' HD3' ' C ' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -138.34 3.83 2.39 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.417 0.687 . . . . 0.0 111.072 179.432 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.45 -17.91 63.0 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 m -73.05 -49.14 40.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -164.59 152.3 10.39 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 126.545 1.938 . . . . 0.0 107.127 172.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.9 3.15 4.08 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 123.472 2.781 . . . . 0.0 112.449 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -136.0 -21.25 1.44 Allowed 'General case' 0 C--N 1.341 0.21 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -176.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.6 tp -68.76 -29.52 67.93 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.39 0.541 . . . . 0.0 110.989 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.29 -34.02 33.92 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.52 -42.45 92.28 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.114 0.457 . . . . 0.0 110.185 177.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -77.0 -31.8 56.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.22 -37.86 86.55 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.989 0.359 . . . . 0.0 111.634 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.2 mmm -80.52 -34.76 35.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.314 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -67.38 -42.43 83.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.322 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -72.49 -20.18 61.41 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.434 -0.506 . . . . 0.0 110.584 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.08 -40.36 95.06 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -70.89 -39.0 74.8 Favored 'Isoleucine or valine' 0 C--N 1.338 0.084 0 CA-C-N 117.447 0.624 . . . . 0.0 109.599 177.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -66.93 -40.17 87.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -23.55 62.21 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.415 0.286 . . . . 0.0 111.192 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.4 t -84.14 -20.18 32.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.16 0.184 . . . . 0.0 110.633 177.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.66 -49.14 13.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.379 -0.201 . . . . 0.0 111.385 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.7 p30 -75.2 -13.05 60.42 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.188 -0.32 . . . . 0.0 111.453 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.19 3.21 40.25 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.314 0.646 . . . . 0.0 111.517 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -139.61 3.36 2.08 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.95 0.5 . . . . 0.0 111.359 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.13 4.66 83.94 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 122.978 0.323 . . . . 0.0 112.823 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.48 1.85 18.02 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 117.499 0.65 . . . . 0.0 111.277 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.23 21.42 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.025 0.53 . . . . 0.0 110.608 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -145.6 -176.76 5.25 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.352 1.061 . . . . 0.0 109.084 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -56.62 155.72 7.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.919 0.488 . . . . 0.0 111.137 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.0 p -70.82 168.47 16.69 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.584 0.707 . . . . 0.0 111.895 -177.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -156.15 -166.85 2.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.309 1.043 . . . . 0.0 108.854 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 72.6 p -145.18 168.43 20.41 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.564 0.346 . . . . 0.0 110.98 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -143.06 20.27 1.94 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.256 0.622 . . . . 0.0 111.304 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -130.87 -166.27 1.67 Allowed 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 123.769 0.828 . . . . 0.0 109.882 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -142.39 11.41 1.91 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.75 16.01 0.06 OUTLIER Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.154 -1.022 . . . . 0.0 115.513 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.8 t -147.4 -3.04 0.56 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.173 1.487 . . . . 0.0 113.181 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.49 -31.34 0.11 Allowed 'General case' 0 C--N 1.334 -0.079 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -71.95 -20.17 61.78 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 171.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.3 p -70.24 -29.53 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.04 0.54 55.05 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.646 0.778 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -115.54 -49.02 2.76 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 124.164 0.986 . . . . 0.0 109.937 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.46 -2.17 6.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 112.462 -175.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.2 mtt-85 -128.77 -7.62 5.04 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.171 0.588 . . . . 0.0 111.77 -177.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 mt -140.3 21.99 2.39 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.182 0.593 . . . . 0.0 111.394 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.4 7.63 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.896 1.278 . . . . 0.0 114.078 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -130.2 -3.43 4.45 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.772 0.715 . . . . 0.0 112.649 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 53.4 ttm -73.79 142.65 46.19 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.449 HG21 ' H ' ' A' ' 98' ' ' SER . 12.4 t -61.89 147.35 89.86 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.38 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.59 1.2 0.06 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 125.217 3.945 . . . . 0.0 117.016 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 25.7 tp -129.19 -26.58 2.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.673 1.124 . . . . 0.0 112.739 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.449 ' H ' HG21 ' A' ' 95' ' ' THR . 73.9 m -68.89 -24.02 64.27 Favored 'General case' 0 C--N 1.337 0.062 0 CA-C-N 119.12 0.873 . . . . 0.0 109.751 175.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -72.66 -25.33 61.23 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 122.183 0.193 . . . . 0.0 110.758 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -80.82 -37.41 30.16 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 176.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.81 -29.96 70.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 176.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.22 -48.41 67.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.502 0.321 . . . . 0.0 110.445 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.2 pp -73.83 -4.72 36.57 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.185 -0.322 . . . . 0.0 111.444 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.2 tp -103.05 -7.31 21.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.214 0.606 . . . . 0.0 112.22 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 82.5 p -140.63 2.05 1.77 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.5 8.51 5.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.807 0.443 . . . . 0.0 110.688 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 5.0 mtm -143.21 -2.7 0.98 Allowed 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.624 0.77 . . . . 0.0 112.338 -178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -139.95 -14.69 1.04 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.471 0.578 . . . . 0.0 112.072 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.56 8.31 25.54 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.015 176.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -63.87 154.81 32.54 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 118.265 1.032 . . . . 0.0 111.312 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 60.9 m -70.79 157.66 89.73 Favored Pre-proline 0 N--CA 1.456 -0.166 0 C-N-CA 123.172 0.589 . . . . 0.0 109.908 178.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -70.23 -16.16 35.5 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.801 2.334 . . . . 0.0 112.076 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.23 -45.01 43.01 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.234 0.47 . . . . 0.0 111.075 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -82.99 -23.61 33.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.39 -30.1 68.94 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 173.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.94 -32.6 63.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -70.28 -22.85 62.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.766 0.427 . . . . 0.0 110.611 175.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.0 tp -83.4 -7.55 59.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 23.5 pt -134.92 11.41 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.775 -0.578 . . . . 0.0 110.369 175.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 54.04 59.85 3.99 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.998 1.319 . . . . 0.0 113.364 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.5 m -138.0 -176.19 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 C-N-CA 124.702 1.201 . . . . 0.0 109.336 176.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -88.66 160.21 17.48 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.6 m -55.97 -40.83 73.84 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 122.745 0.418 . . . . 0.0 111.067 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.5 m -69.81 -20.72 63.44 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.926 0.491 . . . . 0.0 111.787 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.48 -34.38 54.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.424 0.556 . . . . 0.0 110.124 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.3 t -64.98 -36.65 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.061 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.49 -38.45 87.37 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.3 m -71.44 -40.55 70.32 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 119.678 -0.201 . . . . 0.0 110.696 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.02 -34.58 78.34 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.001 0.364 . . . . 0.0 111.82 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -81.17 -27.06 10.61 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.414 0.552 . . . . 0.0 111.032 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 61.6 m -68.95 -37.91 79.12 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -77.13 -25.52 52.18 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 122.275 -0.266 . . . . 0.0 110.658 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.67 -48.4 47.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.399 -0.188 . . . . 0.0 110.557 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.4 -22.61 61.85 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.723 0.238 . . . . 0.0 111.235 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.94 71.34 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.737 0.244 . . . . 0.0 110.371 177.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -75.57 -18.95 59.6 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.875 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.9 mm -78.61 -55.18 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.08 -23.26 67.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.677 0.217 . . . . 0.0 111.194 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.84 -24.35 62.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.448 ' C ' ' H ' ' A' ' 142' ' ' ARG . 17.6 pt20 -158.96 -37.33 0.06 Allowed 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -171.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.7 p 45.63 -4.78 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 -169.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.448 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.0 OUTLIER -161.18 4.15 0.06 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 121.002 1.728 . . . . 0.0 114.088 174.337 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 47.81 39.23 10.13 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.978 0.911 . . . . 0.0 113.174 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -56.07 -28.17 56.5 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -176.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -153.04 172.74 16.39 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.324 0.65 . . . . 0.0 109.984 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 55.5 tp -153.55 151.32 29.64 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.704 0.802 . . . . 0.0 108.984 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 4.9 p -152.48 90.22 3.74 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 120.91 0.386 . . . . 0.0 109.966 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.04 -8.12 18.65 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.257 2.638 . . . . 0.0 111.757 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 -72.95 170.42 14.85 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.193 0.597 . . . . 0.0 110.566 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 172.61 -12.49 0.04 OUTLIER Glycine 0 CA--C 1.529 0.965 0 CA-C-O 119.37 -0.683 . . . . 0.0 112.958 178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 50.8 m -149.55 167.37 26.49 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 117.944 0.872 . . . . 0.0 110.617 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -157.55 177.24 11.64 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.612 0.765 . . . . 0.0 110.187 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -150.44 170.21 19.62 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -151.32 28.39 0.65 Allowed 'General case' 0 CA--C 1.532 0.271 0 O-C-N 122.159 -0.338 . . . . 0.0 111.763 -174.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -137.74 18.45 2.87 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.889 -0.507 . . . . 0.0 111.914 -177.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 16.7 p-80 -139.89 8.25 2.31 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.103 -0.373 . . . . 0.0 111.747 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.0 p80 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 117.329 -1.32 . . . . 0.0 110.983 179.269 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.1 pp -151.96 -178.3 6.67 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.641 0.377 . . . . 0.0 110.759 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -149.54 169.1 21.71 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.464 0.705 . . . . 0.0 110.421 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -154.87 154.59 29.25 Favored Pre-proline 0 N--CA 1.453 -0.304 0 C-N-CA 123.21 0.604 . . . . 0.0 110.661 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -74.01 172.58 15.64 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.419 2.746 . . . . 0.0 111.122 177.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.42 2.13 0.03 OUTLIER Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.711 -0.494 . . . . 0.0 112.48 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -153.72 167.29 30.11 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.868 0.834 . . . . 0.0 109.796 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -153.45 173.68 15.37 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.258 0.623 . . . . 0.0 110.319 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -152.38 172.82 15.9 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.086 0.554 . . . . 0.0 110.35 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -144.04 172.19 13.22 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.34 0.656 . . . . 0.0 110.428 -178.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -144.68 11.45 1.44 Allowed 'General case' 0 CA--C 1.527 0.073 0 C-N-CA 123.825 0.85 . . . . 0.0 111.033 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.16 174.07 13.2 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.786 0.834 . . . . 0.0 109.822 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 13.3 t -144.3 4.83 1.24 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.469 0.307 . . . . 0.0 111.767 -177.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 31.4 m 46.68 36.28 3.63 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.542 0.737 . . . . 0.0 112.37 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -140.84 170.3 16.01 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.545 0.738 . . . . 0.0 109.852 -176.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -140.3 167.62 21.71 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.522 0.729 . . . . 0.0 109.708 -176.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 58.8 m -139.37 159.68 64.98 Favored Pre-proline 0 C--O 1.232 0.15 0 C-N-CA 123.531 0.732 . . . . 0.0 110.157 -176.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -69.31 178.24 4.49 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 123.644 2.896 . . . . 0.0 111.446 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -147.28 -174.39 4.5 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.804 0.842 . . . . 0.0 110.736 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -145.05 147.77 32.95 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 173.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 2.0 t -139.65 21.94 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 122.928 0.491 . . . . 0.0 110.117 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -131.67 15.51 4.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.816 0.847 . . . . 0.0 110.296 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 22.2 m -138.16 20.93 2.8 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.214 1.005 . . . . 0.0 110.124 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -135.24 -19.58 1.7 Allowed 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.849 0.86 . . . . 0.0 111.287 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -139.72 7.0 2.28 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.171 0.989 . . . . 0.0 109.496 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.555 ' HG2' ' H ' ' B' ' 27' ' ' ASP . 17.8 ttp180 50.39 -164.49 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.751 1.221 . . . . 0.0 112.227 -178.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . 0.555 ' H ' ' HG2' ' B' ' 26' ' ' ARG . 8.7 p-10 -65.05 -8.4 16.07 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 123.708 0.803 . . . . 0.0 112.793 -177.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -62.82 -27.78 69.55 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.805 -0.559 . . . . 0.0 111.014 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.34 -37.46 62.97 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.46 -22.11 57.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.44 -0.447 . . . . 0.0 110.85 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.48 -44.23 68.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.856 0.36 . . . . 0.0 110.136 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 68.5 mt -73.71 -37.39 65.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 122.744 0.418 . . . . 0.0 110.095 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.25 -37.76 86.27 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.636 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.1 t -69.49 -37.19 77.11 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 117.74 0.246 . . . . 0.0 111.381 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.89 -30.35 71.45 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 120.545 0.212 . . . . 0.0 111.152 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -105.59 -6.58 19.17 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -67.7 -34.43 76.88 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -57.72 -33.76 68.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.441 0.697 . . . . 0.0 110.345 175.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 23.4 m -67.85 -12.47 60.7 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.183 0.593 . . . . 0.0 112.065 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.406 ' C ' ' H ' ' B' ' 42' ' ' GLU . 44.9 mm -110.2 -12.6 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 118.298 0.499 . . . . 0.0 111.165 -179.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -77.62 25.36 0.19 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.194 0.598 . . . . 0.0 110.991 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.406 ' H ' ' C ' ' B' ' 40' ' ' ILE . 12.6 pt-20 -141.52 176.05 9.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.226 0.61 . . . . 0.0 111.374 -178.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -66.14 178.06 1.25 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.526 1.131 . . . . 0.0 112.326 -177.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -138.25 156.88 73.51 Favored Pre-proline 0 CA--C 1.531 0.216 0 C-N-CA 123.96 0.904 . . . . 0.0 109.923 -178.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -74.55 176.15 10.11 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 123.058 2.505 . . . . 0.0 110.449 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -147.09 -2.21 0.62 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.16 -23.27 67.07 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.807 -0.558 . . . . 0.0 111.802 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.9 mtm -73.16 -35.27 66.42 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 67.7 mt -81.55 -12.32 58.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.713 -0.617 . . . . 0.0 110.084 175.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.0 -20.66 61.68 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 171.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.0 -16.24 62.61 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.987 -0.446 . . . . 0.0 110.417 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' B' ' 54' ' ' LYS . 29.6 mt -90.51 -17.0 27.82 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 173.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -71.47 16.12 0.11 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.014 0.37 . . . . 0.0 111.468 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.486 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -133.8 9.35 3.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.184 0.993 . . . . 0.0 111.171 177.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 pp -153.83 -11.68 0.14 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -141.61 5.07 1.78 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.205 0.911 . . . . 0.0 113.262 -179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 7.6 tp -150.07 21.84 0.86 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.711 0.687 . . . . 0.0 111.54 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.19 158.95 33.92 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.356 -0.84 . . . . 0.0 110.857 177.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 51.4 tp -158.56 155.97 29.3 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 41.9 t -144.06 136.79 13.59 Favored Pre-proline 0 CA--C 1.531 0.235 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 178.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.71 177.02 8.08 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.554 2.836 . . . . 0.0 111.167 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 . . . . . 0 CA--C 1.532 0.258 0 C-N-CA 124.441 1.097 . . . . 0.0 111.735 -179.272 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 110.611 -0.144 . . . . 0.0 110.611 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.6 p -151.0 170.81 18.44 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.092 0.557 . . . . 0.0 109.712 177.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.77 -35.43 74.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 122.624 0.37 . . . . 0.0 111.251 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.75 -27.25 73.2 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 -176.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -73.89 -1.16 18.44 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.413 0.606 . . . . 0.0 111.421 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -135.37 4.31 3.15 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.407 0.683 . . . . 0.0 110.797 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tt -114.56 -41.25 3.45 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.975 0.51 . . . . 0.0 110.113 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.401 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.98 -44.65 99.79 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.5 Cg_endo -72.61 -2.49 11.91 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.092 1.861 . . . . 0.0 112.521 -178.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -135.01 13.35 3.6 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.995 0.518 . . . . 0.0 110.97 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 45.9 tp -62.09 -39.57 59.35 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -75.77 -11.69 20.1 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.665 1.577 . . . . 0.0 113.316 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.405 ' CE1' HD12 ' B' ' 40' ' ' ILE . 47.8 m-85 -70.26 -22.8 62.84 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.66 0.663 . . . . 0.0 112.553 -173.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.0 -29.8 64.59 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 118.664 0.666 . . . . 0.0 109.59 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -80.51 -28.19 37.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.995 0.518 . . . . 0.0 109.8 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -56.29 -22.53 30.92 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.297 1.039 . . . . 0.0 112.171 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -140.27 -8.83 1.14 Allowed 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 117.812 0.278 . . . . 0.0 111.737 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.86 -28.45 73.06 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -72.29 -4.84 32.03 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.789 0.794 . . . . 0.0 111.655 177.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.45 6.3 5.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.192 0.597 . . . . 0.0 111.374 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.6 tp -99.9 -1.95 36.04 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.208 0.603 . . . . 0.0 110.193 177.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 t -148.05 -0.3 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.889 0.875 . . . . 0.0 110.754 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.98 -0.62 10.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.395 0.998 . . . . 0.0 114.919 173.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.7 m -139.18 134.37 32.69 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.176 1.488 . . . . 0.0 110.086 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -72.31 -23.57 61.19 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.002 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -65.19 -39.19 92.51 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 118.275 0.489 . . . . 0.0 110.501 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -83.43 -31.33 26.68 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.124 0.57 . . . . 0.0 110.127 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.2 -45.68 92.99 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -74.63 -26.4 59.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 117.388 0.594 . . . . 0.0 110.939 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.68 -46.38 72.48 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -64.76 -33.36 75.8 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 117.744 0.247 . . . . 0.0 111.117 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.77 -55.27 24.76 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 117.825 0.284 . . . . 0.0 110.656 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -74.5 -29.17 61.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.119 -176.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -25.04 63.58 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 119.789 -0.148 . . . . 0.0 110.984 177.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.88 -45.67 85.03 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 117.894 0.316 . . . . 0.0 110.231 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.6 tt -80.55 -36.45 33.01 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 119.839 -0.744 . . . . 0.0 111.564 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.94 -27.03 68.54 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.341 0.518 . . . . 0.0 110.242 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.45 -1.19 25.86 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.244 0.618 . . . . 0.0 111.662 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.0 mt -118.98 -13.56 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.725 0.81 . . . . 0.0 110.082 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -58.59 -12.31 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.694 0.798 . . . . 0.0 111.799 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.26 3.3 9.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.321 0.649 . . . . 0.0 111.42 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.41 55.26 1.03 Allowed Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.561 0.745 . . . . 0.0 110.531 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.87 -8.93 21.2 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.512 2.808 . . . . 0.0 112.759 -174.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -80.47 -8.58 59.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.776 0.43 . . . . 0.0 111.403 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -88.44 -17.18 30.97 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.294 0.237 . . . . 0.0 111.633 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.52 120.2 80.66 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -53.69 139.68 67.32 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.282 2.655 . . . . 0.0 112.389 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 54.3 mmm-85 -141.69 16.63 2.16 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.779 1.232 . . . . 0.0 110.084 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -128.17 20.85 6.3 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.95 0.9 . . . . 0.0 110.78 -175.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.2 m -139.37 -178.28 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 124.528 1.131 . . . . 0.0 108.999 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.418 ' C ' ' H ' ' A' ' 53' ' ' ARG . 7.2 m-20 -53.79 146.96 24.75 Favored Pre-proline 0 CA--C 1.531 0.233 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.9 11.31 0.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 123.884 3.056 . . . . 0.0 111.676 -176.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.418 ' H ' ' C ' ' A' ' 51' ' ' ASP . 98.8 mtt180 -127.94 -22.21 3.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.631 0.773 . . . . 0.0 111.022 177.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.8 tp -74.42 -34.36 63.21 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.173 0.442 . . . . 0.0 110.251 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.71 -30.4 61.89 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.43 -43.58 93.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.203 0.601 . . . . 0.0 110.111 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -81.01 -29.78 35.08 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -177.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.24 -40.63 90.37 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 117.897 0.317 . . . . 0.0 111.129 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.3 mmm -74.94 -35.74 62.13 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -66.75 -35.91 81.21 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 117.529 0.149 . . . . 0.0 110.647 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -68.71 -27.36 65.88 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.866 0.466 . . . . 0.0 110.017 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.58 -37.32 84.96 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.593 -0.603 . . . . 0.0 111.593 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.7 mm -72.39 -38.91 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.067 0 CA-C-N 118.014 0.907 . . . . 0.0 110.323 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -69.74 -35.5 75.03 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.23 -0.294 . . . . 0.0 110.584 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.31 -28.15 66.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 122.166 -0.333 . . . . 0.0 110.58 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -80.34 -28.06 38.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.429 0.291 . . . . 0.0 110.878 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.63 -32.26 67.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.227 -0.295 . . . . 0.0 111.11 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -87.01 -12.49 47.26 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.406 0.282 . . . . 0.0 110.876 177.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.8 5.55 43.09 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.183 0.593 . . . . 0.0 110.877 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -134.99 1.75 3.03 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.27 0.628 . . . . 0.0 111.027 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.58 25.97 74.97 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-O 119.618 -0.545 . . . . 0.0 112.572 176.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -61.58 -16.35 47.31 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.847 0.823 . . . . 0.0 111.17 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.23 164.2 39.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.561 0.744 . . . . 0.0 110.305 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -141.35 4.27 1.78 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.844 0.858 . . . . 0.0 110.513 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.1 t -159.27 -172.15 3.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.254 1.021 . . . . 0.0 108.921 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.41 ' C ' ' H ' ' A' ' 78' ' ' SER . 87.0 p -130.61 -19.0 3.06 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.225 -0.417 . . . . 0.0 111.609 177.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 58.04 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 174.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 76' ' ' SER . 74.2 m 57.41 168.72 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.899 1.28 . . . . 0.0 113.215 -171.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -149.7 16.26 0.88 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.466 0.706 . . . . 0.0 110.936 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.92 -176.39 4.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.925 0.49 . . . . 0.0 110.289 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -138.87 7.56 2.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.753 0.421 . . . . 0.0 111.857 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -172.51 12.42 0.04 OUTLIER Glycine 0 CA--C 1.529 0.918 0 CA-C-O 119.208 -0.774 . . . . 0.0 114.44 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.7 t -145.93 -0.63 0.8 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.845 1.322 . . . . 0.0 112.81 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -149.68 -45.92 0.13 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.08 -24.37 67.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.24 -28.59 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 O-C-N 122.117 -0.364 . . . . 0.0 110.545 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.63 -0.35 56.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.76 -21.09 2.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 118.168 0.44 . . . . 0.0 111.867 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -81.11 -1.94 46.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.071 0.548 . . . . 0.0 110.962 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -129.19 -9.97 4.74 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.111 0.564 . . . . 0.0 111.734 -177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.8 mp -126.16 7.01 7.16 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.839 0.856 . . . . 0.0 111.43 -174.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.13 -9.31 1.96 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -75.21 -0.82 20.72 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.017 0.527 . . . . 0.0 111.225 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 72.0 mtm -121.13 162.48 20.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 122.94 0.496 . . . . 0.0 111.238 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.473 ' C ' ' H ' ' A' ' 97' ' ' LEU . 28.6 m -67.29 144.21 97.95 Favored Pre-proline 0 N--CA 1.453 -0.303 0 C-N-CA 123.749 0.819 . . . . 0.0 110.585 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -54.59 5.26 0.04 OUTLIER 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 124.829 3.686 . . . . 0.0 115.344 173.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.473 ' H ' ' C ' ' A' ' 95' ' ' THR . 3.3 tm? -123.71 -37.25 2.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.462 0.574 . . . . 0.0 110.086 -174.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 p -67.68 -20.79 65.33 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.307 0.503 . . . . 0.0 110.257 175.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 33.6 mtp-105 -71.7 -23.56 61.66 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.656 0.207 . . . . 0.0 110.839 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -78.99 -38.07 37.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -66.27 -29.78 70.07 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.91 -51.3 67.47 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.86 -4.92 37.84 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 71.2 mt -95.3 -7.43 38.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.26 0.482 . . . . 0.0 111.951 174.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 65.1 p -136.07 8.12 3.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.558 0.617 . . . . 0.0 112.488 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.09 7.66 2.68 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.929 0.491 . . . . 0.0 110.847 176.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.5 tpp -136.05 -15.07 1.77 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -150.6 -21.81 0.23 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.437 0.562 . . . . 0.0 112.397 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 84.32 19.86 59.82 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 119.396 -0.669 . . . . 0.0 113.615 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -56.7 148.51 20.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.371 1.085 . . . . 0.0 110.708 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.3 m -72.68 153.41 91.49 Favored Pre-proline 0 CA--C 1.53 0.206 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -52.65 -30.11 44.34 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.459 2.773 . . . . 0.0 113.252 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.03 -33.9 72.59 Favored 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.749 -0.594 . . . . 0.0 110.808 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -83.26 -36.7 24.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.17 -31.04 68.34 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.916 -0.129 . . . . 0.0 111.24 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.32 -36.54 61.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.879 0.309 . . . . 0.0 110.794 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -69.41 -23.07 63.65 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.78 0.432 . . . . 0.0 111.211 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 23.6 tp -87.7 -3.29 58.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.981 0.512 . . . . 0.0 111.782 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.0 pt -134.38 10.66 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.986 -0.446 . . . . 0.0 110.793 178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 59.43 50.89 7.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.444 1.098 . . . . 0.0 113.561 173.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 28.7 m -136.03 174.66 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 C-N-CA 123.482 0.713 . . . . 0.0 110.189 175.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.17 157.38 36.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.8 m -59.46 -36.58 76.24 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.138 -0.351 . . . . 0.0 110.99 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.7 t -74.28 -23.81 59.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.004 -0.435 . . . . 0.0 111.072 -179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.35 -42.5 65.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.963 -0.461 . . . . 0.0 110.621 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.4 p -68.11 -29.68 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.454 -178.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.23 -37.94 87.28 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 176.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 88.8 m -77.11 -36.53 55.52 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 122.382 -0.199 . . . . 0.0 110.488 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.14 -30.78 71.33 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.135 -0.459 . . . . 0.0 111.505 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.0 m -82.77 -27.69 8.31 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 118.903 0.774 . . . . 0.0 110.805 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 84.5 m -68.1 -38.71 82.6 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -76.7 -27.02 55.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 122.125 -0.359 . . . . 0.0 110.615 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.42 -49.06 45.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.23 -22.92 63.82 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 122.152 -0.342 . . . . 0.0 111.303 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.79 71.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -75.84 -18.9 59.28 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.532 -0.27 . . . . 0.0 111.105 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.0 mm -75.54 -55.38 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 118.402 0.546 . . . . 0.0 109.597 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -65.34 -18.42 65.3 Favored 'General case' 0 CA--C 1.527 0.083 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -75.19 -22.07 58.26 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -159.71 -37.45 0.06 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -171.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 20.0 p 43.41 24.97 0.06 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.822 0.849 . . . . 0.0 112.517 -169.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 71.7 mtt85 -144.47 -5.66 0.74 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.242 0.617 . . . . 0.0 112.475 -172.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 50.51 9.36 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 96.4 mt -142.95 9.55 1.72 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.969 0.804 . . . . 0.0 112.167 -174.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -71.48 -34.53 70.26 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.362 0.528 . . . . 0.0 110.91 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 10.6 mp 46.48 -165.97 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.707 1.203 . . . . 0.0 112.278 -176.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 5.1 t -140.42 53.12 3.83 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 123.671 0.788 . . . . 0.0 110.014 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.34 171.76 17.0 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.395 2.73 . . . . 0.0 111.244 -177.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 90.2 mtm-85 -144.16 162.43 36.32 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 124.232 1.013 . . . . 0.0 109.361 178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 173.14 27.73 0.02 OUTLIER Glycine 0 C--N 1.338 0.642 0 CA-C-O 119.528 -0.596 . . . . 0.0 113.126 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 14.9 t -144.27 177.87 8.31 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 118.094 0.947 . . . . 0.0 110.865 -177.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 57.0 -177.08 0.06 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.963 1.305 . . . . 0.0 112.383 -175.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 53.05 24.13 3.33 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.04 0.936 . . . . 0.0 111.987 -176.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.3 7.28 1.75 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.366 0.667 . . . . 0.0 111.417 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.31 6.3 0.98 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.373 0.669 . . . . 0.0 111.472 -179.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -150.17 8.66 0.64 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.188 0.595 . . . . 0.0 110.797 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 117.742 -1.123 . . . . 0.0 111.384 -178.82 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.477 0.902 0 CA-C-O 120.208 0.051 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 96.1 mt -141.44 31.46 1.7 Allowed 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 124.797 1.239 . . . . 0.0 108.792 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -133.94 14.96 3.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.375 1.07 . . . . 0.0 111.822 -171.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -147.14 163.51 27.96 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.092 0.557 . . . . 0.0 110.88 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -53.23 167.53 0.76 Allowed 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 124.508 3.472 . . . . 0.0 114.203 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.22 175.17 44.27 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 179.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 52.27 19.39 1.09 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.256 1.022 . . . . 0.0 112.983 -178.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -142.9 19.1 1.97 Allowed 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.57 1.148 . . . . 0.0 109.865 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -136.51 18.41 3.12 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.084 0.953 . . . . 0.0 110.977 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -138.37 20.38 2.75 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.641 0.776 . . . . 0.0 110.263 -177.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.31 -6.18 13.18 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.684 0.794 . . . . 0.0 111.833 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -151.59 165.45 34.26 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.433 0.693 . . . . 0.0 109.781 178.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 66.3 m -148.81 178.92 8.24 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.591 0.756 . . . . 0.0 110.165 -177.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 43.7 m -60.66 168.69 2.11 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 123.338 0.655 . . . . 0.0 111.755 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -64.01 -5.81 5.25 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -177.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -92.95 -0.38 57.23 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.934 0.493 . . . . 0.0 111.055 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 16.0 t -153.04 55.27 1.37 Allowed Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 123.562 0.745 . . . . 0.0 110.251 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.93 173.09 11.64 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.42 2.747 . . . . 0.0 111.301 -177.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -148.79 175.37 11.3 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.121 0.568 . . . . 0.0 110.539 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -66.02 -4.83 7.92 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 17.2 m -144.86 176.99 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.109 0 C-N-CA 123.583 0.753 . . . . 0.0 110.164 178.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.9 pm0 -150.72 178.11 9.42 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.634 0.773 . . . . 0.0 110.041 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -143.99 169.03 18.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.052 0.541 . . . . 0.0 110.16 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt 48.17 31.1 2.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.078 0.951 . . . . 0.0 112.552 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -66.73 -5.31 11.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.432 0.693 . . . . 0.0 112.177 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 25.0 ptt-85 -148.35 171.69 15.6 Favored 'General case' 0 C--N 1.337 0.034 0 C-N-CA 123.58 0.752 . . . . 0.0 110.065 177.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -145.82 12.07 1.27 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.126 0.57 . . . . 0.0 110.879 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -59.35 -28.06 66.5 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.275 0.63 . . . . 0.0 112.017 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -69.07 -30.46 72.05 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.43 -15.73 48.54 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.738 0.769 . . . . 0.0 110.687 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.33 -46.31 16.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 mt -68.94 -38.7 79.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.695 177.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -67.69 -29.2 68.41 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.155 -0.45 . . . . 0.0 110.921 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.1 t -67.73 -44.45 77.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.728 0.695 . . . . 0.0 110.312 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.2 -24.41 67.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.248 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -107.44 -9.51 15.96 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -70.36 -36.07 73.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 173.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -69.2 -21.23 63.97 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.24 -0.288 . . . . 0.0 111.143 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 58.7 m -75.79 -10.8 59.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.274 0.629 . . . . 0.0 111.389 177.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.405 HD12 ' CE1' ' A' ' 13' ' ' PHE . 19.1 tt -123.94 30.03 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 122.181 0.991 . . . . 0.0 110.018 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -128.41 28.91 5.39 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.43 0.692 . . . . 0.0 109.574 176.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -142.46 -176.24 4.77 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.662 0.785 . . . . 0.0 110.279 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -60.34 178.79 0.18 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.07 0.948 . . . . 0.0 112.91 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.07 155.64 74.35 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.238 -175.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -76.8 59.09 6.24 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 124.499 3.466 . . . . 0.0 110.533 175.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -59.85 -9.51 2.99 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.609 0.764 . . . . 0.0 111.607 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -56.62 -23.37 40.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.242 0.617 . . . . 0.0 111.619 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 19.3 ptp -75.92 -29.08 58.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.844 -0.535 . . . . 0.0 110.813 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 64.4 mt -80.39 -11.19 59.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 121.615 -0.678 . . . . 0.0 109.461 174.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.78 -20.29 61.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 168.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 50.4 mt -78.45 -8.53 58.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.432 0.293 . . . . 0.0 110.247 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.408 ' C ' ' H ' ' B' ' 54' ' ' LYS . 2.7 mm? -90.42 -18.77 24.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 171.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -74.24 13.7 0.53 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.665 0.386 . . . . 0.0 111.251 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.408 ' H ' ' C ' ' B' ' 52' ' ' LEU . 58.8 pttt -130.97 13.3 5.24 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.119 0.968 . . . . 0.0 109.894 174.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.3 mt -137.5 -26.87 0.97 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.533 0.733 . . . . 0.0 111.394 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.94 -15.14 37.37 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 117.884 0.311 . . . . 0.0 111.581 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -158.23 179.04 9.53 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.346 0.658 . . . . 0.0 110.424 179.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -155.14 168.1 28.16 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.038 0.535 . . . . 0.0 110.61 178.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 34.0 tp -146.55 -6.97 0.52 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.535 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 47.5 t -146.19 137.35 12.75 Favored Pre-proline 0 CA--C 1.532 0.261 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.88 167.8 24.85 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.167 2.578 . . . . 0.0 111.243 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? . . . . . 0 C--N 1.337 0.053 0 C-N-CA 124.029 0.932 . . . . 0.0 109.621 -178.097 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 mmt . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.4 m 60.53 177.54 0.1 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 124.444 1.098 . . . . 0.0 112.851 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.9 tp 61.43 -38.9 0.12 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.476 2.31 . . . . 0.0 114.847 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.6 -24.92 64.05 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 119.105 0.866 . . . . 0.0 112.51 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -68.85 -2.1 8.79 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 117.597 0.698 . . . . 0.0 111.126 177.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -131.01 -21.49 2.67 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.253 0.621 . . . . 0.0 110.974 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 tp -77.91 -44.87 25.74 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.138 -0.351 . . . . 0.0 110.36 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.29 -46.26 99.84 Favored Pre-proline 0 CA--C 1.534 0.346 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -173.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.69 -0.24 9.57 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.307 2.005 . . . . 0.0 112.541 -176.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -133.65 13.29 4.07 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.411 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 42.2 mt -55.05 -43.54 99.12 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.411 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 69.5 Cg_endo -81.12 -12.54 11.74 Favored 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 121.919 1.746 . . . . 0.0 114.016 -170.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -66.03 -23.15 66.5 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 119.123 0.874 . . . . 0.0 111.843 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 mp -69.76 -18.85 63.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 118.089 0.404 . . . . 0.0 110.557 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -98.27 -20.7 17.08 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -58.24 -22.26 51.57 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 123.682 0.793 . . . . 0.0 111.57 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -140.09 -24.93 0.81 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.247 0.219 . . . . 0.0 111.3 177.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -61.33 -29.0 70.27 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -65.47 -32.77 74.57 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.114 0.457 . . . . 0.0 110.635 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.47 -6.21 52.69 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.485 0.314 . . . . 0.0 111.833 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.0 mt -97.44 4.7 50.47 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -155.36 -15.8 0.11 Allowed 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.06 25.34 75.49 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.577 -0.702 . . . . 0.0 112.758 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.4 t -150.67 139.95 21.29 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.188 0.994 . . . . 0.0 110.948 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -81.16 -20.2 41.79 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.425 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -71.82 -36.54 70.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -76.63 -32.3 57.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.22 -43.31 89.55 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -67.92 -31.94 72.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 117.071 0.435 . . . . 0.0 110.633 178.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -71.27 -42.51 68.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.379 0.272 . . . . 0.0 110.406 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -65.3 -41.41 94.13 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.576 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.0 m -68.61 -37.7 78.0 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.127 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.327 -176.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -78.8 -29.8 45.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.577 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.32 -26.58 62.0 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.302 -0.259 . . . . 0.0 110.302 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.2 m -65.59 -40.82 93.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.45 -41.78 54.89 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 110.272 -0.269 . . . . 0.0 110.272 -176.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.92 -24.95 68.09 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.903 -0.498 . . . . 0.0 110.649 -178.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.75 0.46 26.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.39 0.676 . . . . 0.0 111.594 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.1 mt -122.41 -14.85 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.112 0.965 . . . . 0.0 109.977 -176.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.8 -14.83 7.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.463 0.705 . . . . 0.0 111.053 175.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.69 4.41 9.51 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.413 0.685 . . . . 0.0 110.933 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.74 53.05 0.89 Allowed Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.39 0.676 . . . . 0.0 111.295 -176.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -65.01 -10.72 26.62 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.24 2.627 . . . . 0.0 112.55 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -74.87 -13.84 60.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.53 0.332 . . . . 0.0 111.255 176.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -90.05 2.8 54.8 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.048 0.539 . . . . 0.0 111.533 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -133.77 65.08 69.84 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 122.483 0.313 . . . . 0.0 111.135 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -76.39 179.95 5.89 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 124.681 3.587 . . . . 0.0 111.396 -175.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.43 ' C ' ' H ' ' A' ' 50' ' ' VAL . 78.7 mmt-85 -132.56 16.42 4.4 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.662 1.185 . . . . 0.0 109.823 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -71.86 8.89 1.04 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.185 0.994 . . . . 0.0 110.902 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.43 ' H ' ' C ' ' A' ' 48' ' ' ARG . 27.3 m -133.63 178.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 C-N-CA 124.974 1.309 . . . . 0.0 108.693 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.421 ' C ' ' H ' ' A' ' 53' ' ' ARG . 6.9 m-20 -53.73 146.09 27.88 Favored Pre-proline 0 CA--C 1.529 0.166 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -70.18 10.77 0.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.979 3.119 . . . . 0.0 111.983 -175.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.421 ' H ' ' C ' ' A' ' 51' ' ' ASP . 68.5 mtp180 -132.63 -17.53 2.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.325 0.65 . . . . 0.0 111.127 179.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 54.1 tp -75.93 -36.41 59.4 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.374 0.534 . . . . 0.0 110.558 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.81 -32.07 54.51 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -58.6 -42.84 89.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.768 0.827 . . . . 0.0 109.854 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 -79.61 -28.6 40.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -66.94 -41.27 87.26 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.242 0.474 . . . . 0.0 111.257 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 93.4 mmm -75.37 -32.27 60.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.241 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -68.67 -35.93 77.87 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.92 -26.86 67.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.773 0.429 . . . . 0.0 110.117 177.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.84 -38.36 65.69 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.7 mm -74.44 -35.98 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 CA-C-N 117.886 0.843 . . . . 0.0 110.046 177.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -67.68 -32.15 72.62 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.501 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.22 -32.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.937 -0.477 . . . . 0.0 110.207 175.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.1 t -73.22 -26.37 61.11 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.74 -30.86 51.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.334 0.253 . . . . 0.0 110.454 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -76.65 -15.12 59.9 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.107 -0.371 . . . . 0.0 110.314 173.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -93.05 7.58 43.54 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.608 0.763 . . . . 0.0 110.628 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -138.31 0.54 2.11 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.287 0.635 . . . . 0.0 111.39 -179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.92 33.2 46.76 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.641 -0.533 . . . . 0.0 112.525 175.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -123.47 10.7 9.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.017 0.909 . . . . 0.0 111.253 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.73 24.28 1.53 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.874 0.469 . . . . 0.0 111.205 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -102.66 6.3 39.55 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.07 0.548 . . . . 0.0 110.809 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.8 t -155.08 174.37 15.27 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.497 0.719 . . . . 0.0 109.824 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -154.15 176.4 12.3 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.305 0.642 . . . . 0.0 110.816 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -145.94 -12.82 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.972 0.509 . . . . 0.0 112.009 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 m 61.5 168.16 0.1 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.663 1.185 . . . . 0.0 112.817 -173.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -144.69 14.42 1.56 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.03 0.932 . . . . 0.0 110.507 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.3 -179.3 6.75 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.919 0.888 . . . . 0.0 109.578 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -136.34 11.98 3.26 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.441 0.296 . . . . 0.0 111.707 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -164.27 12.08 0.09 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 119.394 -0.67 . . . . 0.0 113.827 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -149.78 7.91 0.66 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 1.127 . . . . 0.0 111.63 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -150.3 -48.24 0.13 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.35 -28.21 41.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 122.553 0.341 . . . . 0.0 110.819 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.8 0.76 55.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.096 0.558 . . . . 0.0 111.926 -178.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -121.48 -39.89 2.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.861 0.465 . . . . 0.0 110.012 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.35 -1.31 7.93 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -130.11 -2.95 4.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.221 0.608 . . . . 0.0 111.337 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 61.8 mt -137.52 20.17 2.91 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.918 0.887 . . . . 0.0 111.13 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.06 4.49 0.05 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -175.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -129.4 0.47 5.06 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.091 0.86 . . . . 0.0 112.085 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 54.5 ttm -71.55 149.55 45.61 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.8 m -57.43 140.11 79.92 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 123.648 0.779 . . . . 0.0 109.707 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.54 5.4 0.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.031 3.154 . . . . 0.0 113.919 -176.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.3 tp -128.97 -22.99 3.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.477 0.581 . . . . 0.0 110.682 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 71.0 m -69.32 -22.89 63.75 Favored 'General case' 0 N--CA 1.457 -0.075 0 O-C-N 121.891 -0.505 . . . . 0.0 109.922 174.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 40.4 mtp-105 -68.05 -32.54 72.96 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 175.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -76.39 -39.0 54.88 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.07 -30.45 71.52 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.1 tp -66.84 -46.59 74.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.402 0.281 . . . . 0.0 110.283 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.0 mt -74.89 -8.94 57.97 Favored 'General case' 0 N--CA 1.46 0.04 0 O-C-N 122.13 -0.356 . . . . 0.0 110.73 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -95.67 -8.4 34.83 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -140.65 -20.34 0.83 Allowed 'General case' 0 C--N 1.339 0.121 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.53 -10.85 58.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.121 0.873 . . . . 0.0 111.591 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 16.1 ptp -149.83 11.3 0.74 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -174.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -138.08 -13.13 1.42 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.856 0.753 . . . . 0.0 112.15 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.84 10.04 36.59 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.009 -0.884 . . . . 0.0 114.493 173.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -59.2 150.44 25.53 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 118.808 1.304 . . . . 0.0 110.132 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 94.4 p -67.87 157.19 87.44 Favored Pre-proline 0 N--CA 1.454 -0.235 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.246 179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -69.45 -16.17 38.7 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 122.775 2.317 . . . . 0.0 110.866 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -79.16 -44.73 21.37 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.63 0.372 . . . . 0.0 110.733 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -78.67 -27.52 45.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.959 -0.463 . . . . 0.0 109.865 177.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.96 -27.64 64.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.905 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.64 -32.55 60.26 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 110.423 -0.214 . . . . 0.0 110.423 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -70.02 -28.95 65.91 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.635 0.374 . . . . 0.0 110.349 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 17.3 tp -76.87 -9.04 58.41 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 21.1 pt -134.98 12.29 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 117.931 0.332 . . . . 0.0 110.812 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 52.34 60.8 3.56 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.904 1.281 . . . . 0.0 113.7 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.36 -175.28 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.43 1.092 . . . . 0.0 109.492 175.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -88.4 160.64 17.48 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.8 m -56.32 -40.49 74.48 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 122.115 -0.365 . . . . 0.0 111.341 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 51.9 m -70.54 -20.54 62.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.688 0.395 . . . . 0.0 111.907 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.91 -37.7 62.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 121.954 -0.466 . . . . 0.0 109.834 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.63 -38.68 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.01 -33.02 74.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.79 -0.078 . . . . 0.0 110.79 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 91.4 m -78.12 -39.66 40.6 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -34.03 77.42 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 119.331 -0.366 . . . . 0.0 111.184 -179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.5 m -80.49 -27.54 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 CA-C-N 118.515 0.598 . . . . 0.0 110.993 178.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.9 m -69.23 -38.78 78.7 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 178.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -76.04 -25.65 55.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.28 -47.85 46.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 117.674 0.216 . . . . 0.0 110.432 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.7 -22.77 65.25 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.337 0.517 . . . . 0.0 111.264 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -77.41 -34.38 54.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.91 0.386 . . . . 0.0 110.587 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -77.39 -27.46 52.49 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 123.366 0.666 . . . . 0.0 110.094 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.9 mm -66.66 -60.07 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.19 -23.69 67.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -171.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -71.9 -10.2 59.44 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.434 ' C ' ' H ' ' A' ' 142' ' ' ARG . 16.6 pt20 -151.53 -50.07 0.12 Allowed 'General case' 0 C--N 1.34 0.19 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 42.9 p 43.57 -10.45 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 127.698 2.399 . . . . 0.0 117.371 -171.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.0 OUTLIER -164.25 12.02 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 120.803 1.638 . . . . 0.0 113.788 -174.301 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -144.92 169.18 18.56 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.645 0.657 . . . . 0.0 112.02 -176.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -126.5 6.42 6.91 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.248 1.019 . . . . 0.0 109.641 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -79.94 21.17 0.57 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.324 1.049 . . . . 0.0 112.258 -174.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.404 HD21 ' H ' ' A' ' 147' ' ' VAL . 0.7 OUTLIER -137.9 165.17 27.17 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.109 -0.369 . . . . 0.0 110.694 -178.561 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.404 ' H ' HD21 ' A' ' 146' ' ' LEU . 29.0 m 39.26 48.7 1.97 Allowed Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 125.017 1.327 . . . . 0.0 113.585 -176.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -75.4 -7.25 18.64 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.192 2.595 . . . . 0.0 111.658 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . 0.572 ' HG2' ' H ' ' A' ' 150' ' ' GLY . 36.8 ttt-85 -155.0 -170.98 3.67 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.271 0.628 . . . . 0.0 109.655 -178.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.572 ' H ' ' HG2' ' A' ' 149' ' ' ARG . . . -146.07 -172.99 16.91 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -177.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 80.9 p -139.51 16.23 2.55 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.862 0.465 . . . . 0.0 112.172 -175.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -71.77 4.48 3.22 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.014 0.526 . . . . 0.0 111.817 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 55.75 12.94 0.93 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.521 1.528 . . . . 0.0 114.329 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 33.3 p-80 -74.96 0.33 16.16 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.652 -0.655 . . . . 0.0 111.039 175.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.34 24.04 0.91 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.499 1.12 . . . . 0.0 110.765 -176.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -146.84 170.97 15.93 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.025 0.53 . . . . 0.0 110.141 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 64.9 m80 . . . . . 0 C--O 1.253 1.239 0 CA-C-O 117.461 -1.257 . . . . 0.0 110.155 -176.935 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.61 164.92 15.75 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.087 0.47 . . . . 0.0 109.754 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -147.18 1.59 0.74 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.509 0.724 . . . . 0.0 110.917 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.04 163.32 51.97 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 123.224 0.61 . . . . 0.0 110.383 178.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -53.41 -16.79 7.94 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.87 3.047 . . . . 0.0 113.537 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.93 170.97 40.05 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -158.07 175.05 14.3 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.277 0.631 . . . . 0.0 109.979 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -143.66 156.83 44.68 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 122.908 0.483 . . . . 0.0 110.154 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -157.11 8.71 0.18 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.227 0.611 . . . . 0.0 110.939 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . 0.466 ' HG3' ' H ' ' B' ' 11' ' ' LYS . 47.2 tptt -150.68 178.28 9.25 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.544 0.738 . . . . 0.0 109.483 -175.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.466 ' H ' ' HG3' ' B' ' 10' ' ' LYS . 21.4 tptm -129.31 16.3 6.07 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.736 0.815 . . . . 0.0 110.438 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.18 175.49 11.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.87 0.868 . . . . 0.0 109.605 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 93.2 p -148.88 -179.81 7.28 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 122.689 0.396 . . . . 0.0 110.892 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 48.1 m -140.19 27.47 2.14 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.462 0.705 . . . . 0.0 111.18 -175.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -129.41 7.0 5.31 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -71.03 -175.18 1.09 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.267 0.627 . . . . 0.0 110.185 174.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 56.4 m -134.52 156.35 78.87 Favored Pre-proline 0 CA--C 1.528 0.129 0 C-N-CA 122.943 0.497 . . . . 0.0 110.591 -176.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -73.12 178.65 6.27 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.971 3.114 . . . . 0.0 111.918 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -147.91 176.31 10.26 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.878 0.871 . . . . 0.0 110.278 -179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -150.96 150.11 30.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 30.4 m -145.52 -176.36 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.035 0.934 . . . . 0.0 110.15 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -142.81 11.26 1.82 Allowed 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.969 0.508 . . . . 0.0 111.453 -176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 16.1 m -143.64 -172.73 3.79 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.423 0.689 . . . . 0.0 109.884 -176.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -131.28 162.46 29.97 Favored 'General case' 0 C--N 1.339 0.109 0 CA-C-O 121.056 0.455 . . . . 0.0 111.681 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -155.26 13.49 0.37 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.139 0.976 . . . . 0.0 110.228 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -59.58 -17.17 30.68 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -171.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -144.66 -8.58 0.64 Allowed 'General case' 0 CA--C 1.527 0.061 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.7 tpt -67.02 -25.23 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.708 0.686 . . . . 0.0 110.707 178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.6 -29.55 65.52 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.14 -27.08 59.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 117.234 0.517 . . . . 0.0 110.549 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.67 -41.52 71.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.38 -43.01 70.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.013 0.525 . . . . 0.0 110.341 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -69.43 -29.79 67.59 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 119.041 -0.505 . . . . 0.0 111.246 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.2 t -65.9 -43.59 87.76 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 118.863 0.756 . . . . 0.0 110.191 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.56 71.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.595 0.236 . . . . 0.0 110.666 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -100.49 -3.13 31.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.183 -0.323 . . . . 0.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -70.42 -31.95 69.36 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -62.86 -33.0 74.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 172.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 20.6 m -81.22 -4.06 54.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.756 0.823 . . . . 0.0 113.101 -177.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 10.4 tp -119.54 -12.02 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 119.166 0.893 . . . . 0.0 112.262 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -83.18 -3.68 57.62 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.897 -0.502 . . . . 0.0 111.172 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.78 170.58 15.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.612 0.72 . . . . 0.0 111.799 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -71.89 -173.76 1.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.068 0.947 . . . . 0.0 110.284 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.9 m -131.58 149.46 73.56 Favored Pre-proline 0 C--O 1.232 0.161 0 C-N-CA 122.608 0.363 . . . . 0.0 110.114 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' B' ' 47' ' ' GLU . 89.1 Cg_endo -76.5 -27.86 7.3 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.291 2.661 . . . . 0.0 113.437 -175.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.5 t70 52.53 -2.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.038 1.735 . . . . 0.0 115.138 -178.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' B' ' 45' ' ' PRO . 14.5 pt-20 -67.54 -17.04 64.5 Favored 'General case' 0 N--CA 1.457 -0.111 0 O-C-N 121.112 -0.992 . . . . 0.0 111.399 -178.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 28.1 mtm -71.05 -31.25 67.64 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.324 -0.235 . . . . 0.0 110.401 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -85.87 -9.72 56.51 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.977 -0.452 . . . . 0.0 109.959 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -73.13 -20.21 60.97 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.708 -0.62 . . . . 0.0 109.552 169.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 80.9 mt -77.22 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.566 0.346 . . . . 0.0 110.245 173.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -88.51 -18.59 27.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.764 0.425 . . . . 0.0 109.957 171.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -77.89 18.07 0.52 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.196 0.598 . . . . 0.0 111.867 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -133.5 1.35 3.41 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.769 0.428 . . . . 0.0 111.919 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 pp -154.16 2.59 0.24 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.47 -0.11 0.57 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.605 0.639 . . . . 0.0 112.201 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 2.3 mt -156.51 159.08 38.26 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.064 0.546 . . . . 0.0 110.04 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -146.52 12.31 1.16 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.64 0.776 . . . . 0.0 110.634 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.1 tp -67.96 -10.61 54.83 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.278 0.631 . . . . 0.0 112.376 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 30.8 m -60.95 154.32 60.61 Favored Pre-proline 0 CA--C 1.531 0.242 0 C-N-CA 123.055 0.542 . . . . 0.0 111.36 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.41 171.07 18.45 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.388 2.726 . . . . 0.0 110.755 177.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 . . . . . 0 CA--C 1.528 0.097 0 C-N-CA 123.656 0.782 . . . . 0.0 110.084 179.112 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.8 ttp . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.4 p -142.51 25.08 1.87 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.132 0.573 . . . . 0.0 111.701 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.94 -35.63 66.86 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.79 0.436 . . . . 0.0 111.527 -178.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.53 -36.02 92.81 Favored Glycine 0 C--N 1.341 0.814 0 O-C-N 121.692 -0.63 . . . . 0.0 111.69 -177.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -73.77 1.87 9.54 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.612 0.765 . . . . 0.0 111.309 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -130.84 1.92 4.38 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.674 0.79 . . . . 0.0 110.955 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.34 -38.15 4.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.293 0.637 . . . . 0.0 109.865 177.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.415 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.29 -43.42 96.62 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.7 Cg_endo -73.34 -1.17 10.23 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.357 2.038 . . . . 0.0 112.867 -176.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -134.14 8.74 3.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.248 0.619 . . . . 0.0 110.409 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.75 -41.87 88.17 Favored Pre-proline 0 N--CA 1.452 -0.362 0 C-N-CA 125.362 1.465 . . . . 0.0 114.141 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.28 -10.76 14.84 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.818 1.679 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -66.94 -20.45 65.9 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.753 -0.592 . . . . 0.0 111.059 -177.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.0 mt -71.8 -21.63 61.68 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.095 0.407 . . . . 0.0 110.71 178.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -94.57 -22.19 18.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -55.8 -27.52 51.55 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 124.579 1.152 . . . . 0.0 111.674 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.9 p90 -140.09 -18.89 0.9 Allowed 'General case' 0 N--CA 1.458 -0.074 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.51 -25.74 74.63 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -81.8 -9.52 59.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.377 0.588 . . . . 0.0 110.978 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -109.4 -1.32 18.5 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.616 0.767 . . . . 0.0 110.497 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.5 tp -89.83 5.96 43.88 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.091 0.956 . . . . 0.0 109.444 175.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.2 p -142.28 -14.26 0.79 Allowed 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.696 0.799 . . . . 0.0 111.902 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.453 ' HA3' ' H ' ' A' ' 77' ' ' GLN . . . 64.04 13.86 54.27 Favored Glycine 0 CA--C 1.53 1.031 0 CA-C-O 119.619 -0.545 . . . . 0.0 112.965 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.5 t -142.06 133.25 26.24 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.887 0.843 . . . . 0.0 110.332 -178.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -70.54 -27.16 63.95 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.168 -177.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -75.03 -35.88 61.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.52 -0.112 . . . . 0.0 110.798 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -75.92 -32.4 59.58 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.504 -0.122 . . . . 0.0 110.894 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.3 -42.45 42.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -71.91 -27.89 63.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.591 0.696 . . . . 0.0 111.375 -177.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.71 -26.28 34.76 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.782 0.719 . . . . 0.0 111.747 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -73.8 -31.21 63.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.812 0.733 . . . . 0.0 109.897 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.6 t -63.92 -51.88 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -73.99 -27.78 61.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.409 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.98 -25.09 61.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 117.461 0.118 . . . . 0.0 110.734 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 69.3 m -65.02 -45.37 85.81 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 119.093 -0.479 . . . . 0.0 110.327 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.88 -35.18 67.1 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.605 -178.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -62.91 -23.95 67.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.532 -0.73 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.8 -0.1 33.11 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.82 0.448 . . . . 0.0 111.687 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 19.5 mm -110.87 -19.55 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.373 0.669 . . . . 0.0 109.494 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.68 -13.76 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 124.137 0.975 . . . . 0.0 113.076 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 2.24 9.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.859 -0.526 . . . . 0.0 111.181 -178.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -160.55 59.17 1.15 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 C-N-CA 123.136 0.574 . . . . 0.0 110.419 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -65.28 -10.72 27.02 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.441 2.761 . . . . 0.0 112.679 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -76.35 -13.12 60.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.963 0.505 . . . . 0.0 111.446 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -80.11 -22.62 41.94 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.044 0.383 . . . . 0.0 111.463 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -78.36 121.59 83.99 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -50.44 142.55 29.87 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.558 2.839 . . . . 0.0 112.998 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.0 mmt85 -134.98 8.94 3.52 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.934 0.894 . . . . 0.0 109.433 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -139.69 20.82 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.506 1.122 . . . . 0.0 110.819 -173.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 t -133.4 170.57 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -53.26 144.54 29.53 Favored Pre-proline 0 N--CA 1.455 -0.209 0 O-C-N 122.127 -0.358 . . . . 0.0 110.604 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.9 11.87 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 124.176 3.251 . . . . 0.0 112.008 -175.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -131.14 -27.08 2.06 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.378 0.671 . . . . 0.0 110.512 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.54 -36.86 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.05 -0.406 . . . . 0.0 110.261 177.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.13 -32.95 65.3 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -58.91 -45.25 90.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.283 0.633 . . . . 0.0 109.718 175.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -76.07 -25.92 55.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.895 -176.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -68.67 -42.54 77.74 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.534 0.607 . . . . 0.0 111.624 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 81.3 mmm -73.21 -33.52 65.42 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.488 0.585 . . . . 0.0 110.948 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -67.78 -38.92 84.01 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.495 177.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -66.86 -25.3 66.34 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.21 -36.92 71.57 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.3 mm -70.38 -41.02 78.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 117.794 0.797 . . . . 0.0 110.011 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -70.21 -34.03 72.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.643 -0.132 . . . . 0.0 110.643 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.35 -33.46 74.32 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.053 -0.404 . . . . 0.0 110.437 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.2 t -73.36 -30.63 63.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.14 -28.02 65.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.317 0.247 . . . . 0.0 111.024 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -89.43 -13.2 38.18 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.424 0.289 . . . . 0.0 110.934 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.84 2.03 47.44 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.011 0.525 . . . . 0.0 111.751 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -140.09 2.35 1.91 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.635 0.374 . . . . 0.0 111.275 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.05 85.68 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.944 -0.473 . . . . 0.0 113.228 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.16 -11.76 51.42 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 117.835 0.817 . . . . 0.0 111.668 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.09 135.7 12.48 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.416 0.686 . . . . 0.0 109.333 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -148.99 4.04 0.62 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.359 0.664 . . . . 0.0 111.368 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -158.43 -172.77 3.99 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.939 0.496 . . . . 0.0 110.159 -175.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.0 p -138.44 -177.27 4.78 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.536 0.734 . . . . 0.0 110.222 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.628 ' HG2' ' H ' ' A' ' 78' ' ' SER . 33.7 tt0 -139.44 -170.03 2.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 122.862 0.465 . . . . 0.0 110.286 -174.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.628 ' H ' ' HG2' ' A' ' 77' ' ' GLN . 66.1 m -130.97 50.98 2.18 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.798 0.839 . . . . 0.0 110.311 -176.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -70.57 25.87 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.341 1.056 . . . . 0.0 112.225 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.49 ' H ' ' C ' ' A' ' 78' ' ' SER . . . -147.46 -178.78 6.43 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.944 1.298 . . . . 0.0 108.993 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.72 4.87 2.37 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -176.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.61 22.45 0.02 OUTLIER Glycine 0 CA--C 1.527 0.792 0 C-N-CA 120.27 -0.967 . . . . 0.0 114.279 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.4 t -146.93 -15.62 0.41 Allowed 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.668 1.234 . . . . 0.0 113.222 -177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -141.22 -39.6 0.4 Allowed 'General case' 0 N--CA 1.461 0.104 0 O-C-N 121.694 -0.629 . . . . 0.0 109.729 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.11 -27.18 67.86 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 173.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.73 -24.71 36.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 122.815 0.446 . . . . 0.0 110.668 177.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.88 -0.74 57.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -177.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.62 -23.78 2.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.475 0.579 . . . . 0.0 111.757 174.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.31 -1.62 24.51 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.011 0.524 . . . . 0.0 111.298 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -122.95 -11.59 8.09 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 122.972 0.509 . . . . 0.0 111.034 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.473 ' C ' ' H ' ' A' ' 93' ' ' ARG . 3.0 mm? -130.08 29.56 4.91 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.198 0.999 . . . . 0.0 110.325 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.97 10.39 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.655 1.182 . . . . 0.0 113.726 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.473 ' H ' ' C ' ' A' ' 91' ' ' LEU . 87.9 mmt-85 -130.08 0.18 4.69 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.413 0.685 . . . . 0.0 111.513 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.1 ttm -83.56 149.79 26.36 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.721 0.408 . . . . 0.0 110.432 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.1 m -63.52 138.97 97.51 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 123.722 0.809 . . . . 0.0 109.878 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.85 5.79 1.24 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.058 3.172 . . . . 0.0 113.364 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -121.3 -38.13 2.84 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.4 m -69.28 -24.23 63.93 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.835 -0.54 . . . . 0.0 109.955 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -70.73 -36.17 73.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.175 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -80.74 -24.1 38.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 118.613 0.642 . . . . 0.0 110.233 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.14 -33.91 76.47 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 173.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.5 tp -66.95 -41.17 87.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.6 mt -71.49 -5.09 30.5 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.527 0.331 . . . . 0.0 111.207 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 21.2 tp -111.81 -4.76 14.53 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.225 0.61 . . . . 0.0 112.216 -175.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -138.64 5.03 2.4 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -134.38 5.65 3.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.859 0.299 . . . . 0.0 111.518 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.3 mtm -136.91 2.43 2.6 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.637 0.775 . . . . 0.0 111.887 176.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -148.37 -19.64 0.33 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.566 0.621 . . . . 0.0 112.404 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 66.96 15.88 65.54 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-O 119.253 -0.749 . . . . 0.0 113.614 175.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -57.69 154.24 12.01 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.524 1.162 . . . . 0.0 111.453 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -63.31 146.35 96.27 Favored Pre-proline 0 N--CA 1.45 -0.448 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.554 175.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.37 -16.35 51.09 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 122.566 2.177 . . . . 0.0 111.364 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -73.99 -43.52 57.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.969 0.35 . . . . 0.0 110.268 178.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -78.09 -29.63 49.16 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.51 -28.82 67.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.913 -0.13 . . . . 0.0 110.812 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -74.32 -35.24 63.64 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -68.93 -26.26 64.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.659 0.384 . . . . 0.0 111.156 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -80.06 -9.07 59.67 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 18.4 pt -134.79 13.89 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 118.602 0.637 . . . . 0.0 111.371 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 58.97 53.07 5.84 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.683 1.193 . . . . 0.0 114.02 175.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.1 m -137.77 -175.69 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 C-N-CA 123.477 0.711 . . . . 0.0 110.057 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -91.88 162.31 14.48 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 175.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.1 m -58.62 -39.07 79.44 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 122.029 -0.419 . . . . 0.0 111.655 -177.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.8 p -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -74.58 -36.68 63.04 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 177.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.33 -38.05 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -61.79 -37.85 85.88 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.459 0.118 . . . . 0.0 111.001 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.5 m -75.45 -38.41 59.69 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 122.123 -0.36 . . . . 0.0 110.76 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -66.53 -31.97 73.03 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.389 -0.339 . . . . 0.0 111.727 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -82.19 -26.87 9.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 CA-C-N 118.689 0.677 . . . . 0.0 110.732 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 67.0 m -68.37 -35.85 78.33 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -78.22 -27.49 47.76 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.212 -0.305 . . . . 0.0 110.537 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.84 -42.52 70.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.278 -0.264 . . . . 0.0 110.666 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -75.58 -22.24 57.13 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.11 -0.369 . . . . 0.0 111.081 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.27 -36.64 69.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -73.72 -21.32 60.26 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 119.448 -0.311 . . . . 0.0 110.66 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 11.5 mm -74.14 -53.56 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.335 0.516 . . . . 0.0 109.665 174.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.95 -22.06 66.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.392 0.277 . . . . 0.0 111.634 -176.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -73.68 -24.89 60.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -157.64 -36.38 0.07 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -168.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 27.7 p 44.12 19.61 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.798 1.239 . . . . 0.0 114.236 -171.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 20.6 ptt-85 -154.95 -13.85 0.12 Allowed 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -173.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 54.15 20.03 2.38 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 115.427 1.639 . . . . 0.0 115.427 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -78.36 12.13 2.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 119.065 0.848 . . . . 0.0 110.816 173.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -140.27 169.16 18.2 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.993 0.517 . . . . 0.0 110.813 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -156.1 177.74 11.08 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.691 0.797 . . . . 0.0 110.18 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.411 HG13 ' H ' ' A' ' 149' ' ' ARG . 40.4 t -142.04 132.54 12.78 Favored Pre-proline 0 N--CA 1.455 -0.198 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.05 -16.01 1.55 Allowed 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 125.108 3.872 . . . . 0.0 115.102 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . 0.58 ' HG2' ' H ' ' A' ' 150' ' ' GLY . 28.0 ttp180 51.19 -162.46 0.07 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.945 0.898 . . . . 0.0 111.158 -176.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . 0.58 ' H ' ' HG2' ' A' ' 149' ' ' ARG . . . -171.2 -179.34 42.27 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 78.5 p -147.05 9.49 0.98 Allowed 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.294 0.638 . . . . 0.0 111.395 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 58.22 13.22 2.23 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.738 1.215 . . . . 0.0 114.062 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -151.2 162.24 41.25 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 118.382 0.537 . . . . 0.0 110.811 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 52.5 p-80 -167.29 169.85 12.11 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.144 0.577 . . . . 0.0 110.67 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 51.5 t60 48.21 22.49 0.44 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.121 1.368 . . . . 0.0 114.24 177.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -151.54 163.9 38.02 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.726 -0.609 . . . . 0.0 110.541 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 19.5 p-80 . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.116 1.366 . . . . 0.0 112.329 -177.82 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.5 mmt . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 51.33 27.0 3.34 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.362 1.065 . . . . 0.0 112.014 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -142.01 -0.81 1.28 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.818 0.447 . . . . 0.0 112.162 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -157.63 108.6 1.81 Allowed Pre-proline 0 N--CA 1.453 -0.313 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -49.76 141.27 28.25 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 124.526 3.484 . . . . 0.0 112.822 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 167.62 -178.4 41.58 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 111.691 -0.564 . . . . 0.0 111.691 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -153.5 159.16 42.19 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.664 0.786 . . . . 0.0 109.506 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -144.9 4.08 1.1 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.152 0.581 . . . . 0.0 112.445 -176.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -152.47 167.9 27.28 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.418 0.554 . . . . 0.0 111.234 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -156.28 163.53 39.42 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.414 ' C ' ' H ' ' B' ' 13' ' ' SER . 75.6 mmtt 48.03 26.27 0.96 Allowed 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.366 1.066 . . . . 0.0 112.397 -177.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.77 10.14 0.42 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.654 0.781 . . . . 0.0 112.627 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' SER . . . . . 0.414 ' H ' ' C ' ' B' ' 11' ' ' LYS . 68.7 m -144.23 15.28 1.67 Allowed 'General case' 0 C--O 1.232 0.139 0 C-N-CA 123.526 0.73 . . . . 0.0 110.708 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 41.2 m -145.76 167.45 23.15 Favored 'General case' 0 C--N 1.338 0.105 0 C-N-CA 122.937 0.495 . . . . 0.0 110.224 -177.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -64.31 137.8 58.1 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -157.63 -172.11 3.83 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 124.16 0.984 . . . . 0.0 109.218 176.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 66.3 m -137.39 155.41 75.6 Favored Pre-proline 0 N--CA 1.456 -0.145 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -69.85 149.26 66.09 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.375 2.716 . . . . 0.0 111.177 -177.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.43 172.6 15.3 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.045 0.938 . . . . 0.0 109.426 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -64.94 2.52 0.71 Allowed 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 178.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 18.6 m -138.72 12.96 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 124.085 0.954 . . . . 0.0 111.062 178.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 74.7 mm-40 -141.26 5.71 1.89 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.615 0.766 . . . . 0.0 110.913 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 20.6 t -154.58 -179.93 8.45 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 122.809 0.443 . . . . 0.0 110.102 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -63.13 177.22 0.63 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.724 0.81 . . . . 0.0 111.235 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -131.25 0.87 4.15 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.055 0.542 . . . . 0.0 111.759 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 20.6 ptp180 -158.95 160.94 36.6 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 122.95 0.5 . . . . 0.0 110.738 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -154.39 -6.67 0.15 Allowed 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 123.392 0.677 . . . . 0.0 110.65 176.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -63.88 -24.2 67.65 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.116 -0.365 . . . . 0.0 110.776 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -73.86 -34.06 56.68 Favored Glycine 0 C--N 1.337 0.612 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.03 -21.55 63.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.265 0.533 . . . . 0.0 110.743 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.45 -41.16 20.17 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.77 -42.11 58.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.448 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -66.28 -33.34 75.52 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.841 -178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.0 t -66.02 -42.66 89.34 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.475 0.58 . . . . 0.0 109.832 178.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -18.77 65.27 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -107.87 -12.47 15.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.082 -0.386 . . . . 0.0 111.571 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -69.18 -35.87 76.74 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -70.59 -23.13 62.52 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 57.9 m -70.92 -12.22 61.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.959 0.504 . . . . 0.0 111.435 175.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 38.5 pt -131.54 11.64 1.81 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.804 0.442 . . . . 0.0 111.641 -177.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -80.13 21.98 0.55 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.236 0.614 . . . . 0.0 110.553 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -137.7 -179.04 5.51 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.163 0.585 . . . . 0.0 111.107 -174.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -61.63 -179.9 0.21 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.066 0.946 . . . . 0.0 112.094 178.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.77 155.03 81.92 Favored Pre-proline 0 CA--C 1.528 0.113 0 C-N-CA 122.887 0.475 . . . . 0.0 110.016 -177.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -74.73 176.3 9.99 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.102 2.535 . . . . 0.0 110.78 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -146.46 -0.78 0.74 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.466 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -62.38 -24.38 67.34 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.004 0.521 . . . . 0.0 111.569 -179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 56.7 mtm -78.98 -37.11 40.2 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.577 0.351 . . . . 0.0 110.752 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -80.39 -17.02 53.09 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -69.02 -21.09 64.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.225 -0.297 . . . . 0.0 110.221 171.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -68.53 -20.56 64.57 Favored 'General case' 0 C--O 1.228 -0.052 0 O-C-N 122.024 -0.422 . . . . 0.0 110.03 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.469 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.6 mt -80.46 -21.38 42.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.214 173.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -75.18 10.92 1.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 172.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.469 ' H ' ' C ' ' B' ' 52' ' ' LEU . 37.6 ttpt -120.08 -1.27 10.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.822 1.249 . . . . 0.0 110.112 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -149.43 -13.91 0.29 Allowed 'General case' 0 C--N 1.34 0.184 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -126.64 20.1 7.24 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.293 0.637 . . . . 0.0 111.908 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 tt -144.37 139.76 28.65 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -156.73 172.62 18.29 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.654 0.782 . . . . 0.0 110.256 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -151.45 170.69 18.99 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.081 0.552 . . . . 0.0 110.907 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.3 p -153.02 139.35 12.33 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.76 170.09 20.42 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.12 2.547 . . . . 0.0 111.059 177.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 57.1 mmm-85 . . . . . 0 CA--C 1.528 0.128 0 C-N-CA 124.34 1.056 . . . . 0.0 109.941 -179.414 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 110.41 -0.218 . . . . 0.0 110.41 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.7 p -152.98 3.62 0.32 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -63.64 -12.43 33.68 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.57 -27.97 61.88 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -75.3 1.0 14.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.699 0.8 . . . . 0.0 111.193 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -132.27 -1.85 3.57 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.591 0.756 . . . . 0.0 111.262 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 44.7 mt -111.81 -31.53 6.92 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.585 0.354 . . . . 0.0 111.052 176.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -71.39 -44.41 13.07 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.73 -3.86 14.28 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.253 1.969 . . . . 0.0 112.834 -175.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -135.47 14.58 3.45 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 122.949 0.5 . . . . 0.0 110.643 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 16.4 tp -56.0 -39.74 79.66 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -174.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.39 -4.47 13.7 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.083 1.855 . . . . 0.0 112.667 -178.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -65.51 -23.29 66.85 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.665 0.666 . . . . 0.0 111.733 -176.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mp -74.49 -18.8 60.57 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.561 -0.712 . . . . 0.0 110.309 176.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -99.58 -27.92 13.46 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.589 0.356 . . . . 0.0 111.168 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -61.39 -15.67 38.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -140.41 -16.8 0.92 Allowed 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 174.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.46 -26.34 74.3 Favored Glycine 0 C--N 1.338 0.661 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -66.45 -37.63 85.58 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.014 0.907 . . . . 0.0 110.497 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.76 -16.07 54.79 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.529 0.331 . . . . 0.0 111.332 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.4 tp -79.53 -2.21 41.2 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.897 0.479 . . . . 0.0 111.952 -177.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.8 t -147.86 -16.78 0.36 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.907 -0.496 . . . . 0.0 112.333 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.33 11.55 85.4 Favored Glycine 0 CA--C 1.527 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 113.138 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.9 m -142.8 123.26 13.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.141 0.97 . . . . 0.0 110.12 -178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -66.73 -24.1 66.19 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.762 -177.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -68.72 -39.13 80.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.1 0.409 . . . . 0.0 110.891 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -82.36 -31.79 29.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.74 -43.72 95.85 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.57 -33.67 73.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.428 0.614 . . . . 0.0 110.546 178.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.3 -45.63 75.96 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 122.543 0.337 . . . . 0.0 110.968 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -64.13 -34.41 77.99 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.035 0.38 . . . . 0.0 111.032 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.36 -55.07 26.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 117.812 0.278 . . . . 0.0 111.116 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.1 ttp180 -75.51 -27.12 58.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.01 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.02 -26.74 64.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 117.499 0.136 . . . . 0.0 110.758 176.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.8 m -65.87 -38.09 87.88 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.7 -43.19 59.97 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -61.98 -18.57 60.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.848 0.459 . . . . 0.0 110.96 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -86.77 0.3 55.01 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.077 0.551 . . . . 0.0 112.078 177.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 77.6 mt -120.68 -20.9 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 122.724 0.41 . . . . 0.0 111.407 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.9 m -65.88 -4.5 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 118.832 0.742 . . . . 0.0 112.326 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.12 3.64 7.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.647 0.779 . . . . 0.0 110.31 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.0 56.29 1.26 Allowed Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.648 0.779 . . . . 0.0 110.303 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -64.99 -10.96 27.52 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.005 2.47 . . . . 0.0 111.782 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.26 -16.46 62.48 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.968 -0.457 . . . . 0.0 110.479 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -84.5 3.07 38.11 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.005 0.522 . . . . 0.0 110.909 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -129.36 68.17 79.81 Favored Pre-proline 0 N--CA 1.454 -0.244 0 C-N-CA 122.408 0.283 . . . . 0.0 110.783 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.03 167.71 24.01 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.827 3.018 . . . . 0.0 110.746 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.2 11.28 11.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.82 7.55 3.05 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.072 0.949 . . . . 0.0 111.558 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 32.6 m -134.92 177.41 6.87 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.777 0.831 . . . . 0.0 109.911 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.439 ' C ' ' H ' ' A' ' 53' ' ' ARG . 9.7 m-20 -59.32 151.23 59.99 Favored Pre-proline 0 N--CA 1.455 -0.22 0 C-N-CA 122.43 0.292 . . . . 0.0 110.291 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -70.64 12.71 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.063 3.176 . . . . 0.0 111.629 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 51' ' ' ASP . 98.6 mtt180 -133.52 -17.61 2.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.438 0.695 . . . . 0.0 111.734 178.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 41.8 tp -74.45 -31.65 62.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.565 0.621 . . . . 0.0 110.198 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.91 -26.41 64.71 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -67.34 -42.17 83.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -79.87 -32.58 40.41 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.562 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -63.72 -44.81 92.51 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.632 0.651 . . . . 0.0 111.448 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.3 mmm -76.73 -33.4 58.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.01 -176.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -69.88 -33.31 72.07 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.477 177.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -67.53 -29.02 68.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.29 -37.98 71.19 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 49.5 mm -72.21 -38.25 61.71 Favored 'Isoleucine or valine' 0 C--O 1.23 0.074 0 CA-C-N 117.692 0.746 . . . . 0.0 110.267 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -69.52 -33.76 73.28 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.264 -0.272 . . . . 0.0 110.554 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.05 -33.11 73.06 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.106 -0.371 . . . . 0.0 110.262 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.2 t -73.06 -25.71 61.02 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.15 -36.5 61.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.169 0.187 . . . . 0.0 110.594 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -75.64 -23.86 56.38 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.3 -0.25 . . . . 0.0 110.452 176.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -72.6 2.14 6.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.262 0.625 . . . . 0.0 111.869 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -140.11 3.85 2.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.038 0.535 . . . . 0.0 111.001 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 72.19 13.95 76.57 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.82 -0.433 . . . . 0.0 112.524 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -69.14 -6.11 26.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 117.675 0.737 . . . . 0.0 111.454 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.28 159.83 43.2 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.062 -0.399 . . . . 0.0 110.69 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -148.69 -166.67 2.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.973 1.309 . . . . 0.0 108.76 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -57.63 173.23 0.3 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.116 0.566 . . . . 0.0 110.617 174.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.6 p -138.14 171.54 14.25 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.26 0.552 . . . . 0.0 111.996 -173.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -145.5 16.72 1.48 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.713 0.805 . . . . 0.0 110.67 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m 61.77 179.06 0.12 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.465 1.106 . . . . 0.0 112.642 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -141.39 25.78 2.02 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.882 0.473 . . . . 0.0 111.394 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.64 -173.63 2.79 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.714 0.806 . . . . 0.0 109.928 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.8 8.0 3.26 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -173.27 10.29 0.04 OUTLIER Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.643 -0.789 . . . . 0.0 114.446 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.6 t -148.38 9.09 0.83 Allowed 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.52 1.16 . . . . 0.0 112.269 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -154.02 -41.79 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.988 -0.445 . . . . 0.0 109.99 174.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.19 -23.09 64.8 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 121.65 -0.656 . . . . 0.0 109.808 174.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.43 -26.1 38.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 122.446 0.299 . . . . 0.0 110.364 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.64 -3.76 54.33 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.184 0.594 . . . . 0.0 111.845 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -129.75 -13.07 4.24 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.07 -1.92 31.47 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.098 0.559 . . . . 0.0 110.794 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -126.49 -15.62 5.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.489 0.716 . . . . 0.0 110.594 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -135.96 38.89 2.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.782 1.233 . . . . 0.0 110.204 -176.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.33 2.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -130.42 7.81 4.97 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.916 0.78 . . . . 0.0 112.333 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 tpp -61.86 142.78 57.16 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.014 0.37 . . . . 0.0 110.034 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 m -64.07 137.88 97.24 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.091 0.556 . . . . 0.0 109.665 178.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -68.81 5.5 1.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.905 3.07 . . . . 0.0 113.394 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -127.54 -33.67 2.3 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.5 m -67.84 -24.16 65.24 Favored 'General case' 0 C--N 1.337 0.057 0 O-C-N 121.858 -0.526 . . . . 0.0 109.951 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttm-85 -67.09 -32.52 73.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.671 0.388 . . . . 0.0 110.195 174.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -74.51 -37.48 63.09 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.34 -34.07 75.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 122.184 -0.322 . . . . 0.0 110.285 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.2 tp -65.96 -42.59 89.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.676 0.39 . . . . 0.0 110.947 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.13 -6.68 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.712 -0.617 . . . . 0.0 111.347 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -97.94 -4.9 35.45 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 175.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 69.4 p -134.84 3.37 3.22 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -140.16 10.43 2.35 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.246 0.475 . . . . 0.0 112.084 177.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.407 ' SD ' ' HB3' ' B' ' 32' ' ' LEU . 2.4 mtm -137.49 -8.9 1.69 Allowed 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -150.27 -9.01 0.28 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.012 0.824 . . . . 0.0 112.683 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 69.51 23.07 76.71 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.084 -0.842 . . . . 0.0 113.738 173.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -56.19 150.83 13.5 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.709 1.254 . . . . 0.0 109.98 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.4 m -66.07 155.61 86.75 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.3 -19.62 43.72 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 122.382 2.055 . . . . 0.0 111.357 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -73.57 -33.49 64.68 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.997 -0.439 . . . . 0.0 110.224 176.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -83.4 -37.91 22.65 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.31 0.244 . . . . 0.0 110.434 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.11 -27.4 68.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.213 -0.304 . . . . 0.0 111.03 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.16 -32.07 33.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 117.688 0.222 . . . . 0.0 110.721 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -71.4 -30.55 66.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.134 0.574 . . . . 0.0 110.836 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 58.6 mt -74.14 -5.77 43.72 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 176.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.0 pt -135.38 11.57 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 118.725 0.693 . . . . 0.0 111.289 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 55.06 54.55 8.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.516 1.126 . . . . 0.0 114.016 176.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.9 m -136.06 176.07 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.111 0.564 . . . . 0.0 110.266 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -74.38 157.3 35.93 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 88.4 m -60.97 -36.23 78.86 Favored 'General case' 0 N--CA 1.457 -0.106 0 O-C-N 122.193 -0.317 . . . . 0.0 110.81 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 95.6 p -75.94 -21.17 57.32 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.063 -0.398 . . . . 0.0 111.134 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -74.67 -43.29 55.98 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.087 -0.383 . . . . 0.0 110.413 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.63 -31.5 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 C-N-CA 119.481 -0.888 . . . . 0.0 110.063 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -63.67 -34.11 77.12 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.8 m -77.13 -37.59 53.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.222 -0.299 . . . . 0.0 110.422 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.03 -33.79 76.88 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.383 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.12 -26.86 9.21 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 118.314 0.506 . . . . 0.0 111.096 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.5 m -67.59 -38.5 84.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -78.34 -25.2 46.34 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 122.263 -0.273 . . . . 0.0 110.5 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.72 48.61 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.744 0.247 . . . . 0.0 110.342 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.79 -22.21 63.34 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.084 -0.385 . . . . 0.0 110.968 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.1 -36.41 69.45 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.387 -0.196 . . . . 0.0 110.967 176.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -83.79 -16.8 43.31 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.759 -0.588 . . . . 0.0 111.094 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 9.4 mm -62.24 -52.63 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.53 -17.31 60.76 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.88 -15.6 63.1 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -147.47 -44.4 0.17 Allowed 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 47.6 p 44.72 -12.3 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 118.759 2.874 . . . . 0.0 118.759 -177.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.19 7.09 0.09 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 121.354 1.888 . . . . 0.0 113.617 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.08 -173.92 4.37 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.899 0.48 . . . . 0.0 110.024 -175.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -149.48 168.51 23.26 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.229 0.612 . . . . 0.0 110.472 178.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -155.0 164.22 39.21 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -178.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 41.0 tp -62.36 141.48 58.29 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.219 0.607 . . . . 0.0 110.149 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 18.5 m -147.99 152.56 40.47 Favored Pre-proline 0 C--O 1.232 0.163 0 C-N-CA 123.023 0.529 . . . . 0.0 110.074 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -75.46 -1.64 11.57 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 124.107 3.205 . . . . 0.0 112.157 177.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 -76.75 6.86 5.34 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 162.99 4.88 0.04 OUTLIER Glycine 0 CA--C 1.526 0.749 0 CA-C-O 118.935 -0.925 . . . . 0.0 114.296 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 39.8 m -142.31 2.44 1.47 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.957 1.379 . . . . 0.0 113.01 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -154.38 165.12 37.38 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.281 0.491 . . . . 0.0 110.316 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 25.7 p80 -157.5 167.85 29.0 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.095 0.558 . . . . 0.0 110.42 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 27.8 p80 -155.98 172.52 18.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.158 0.583 . . . . 0.0 110.262 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -146.06 22.01 1.39 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.374 0.669 . . . . 0.0 111.185 -176.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -140.5 20.38 2.38 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.738 0.415 . . . . 0.0 111.676 -174.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 . . . . . 0 C--O 1.251 1.167 0 CA-C-O 117.739 -1.124 . . . . 0.0 110.748 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 16.2 tpt . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 54.5 tp -152.87 -26.88 0.15 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.626 0.371 . . . . 0.0 110.781 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -151.82 -7.33 0.23 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.703 0.401 . . . . 0.0 111.577 178.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -155.52 150.44 20.63 Favored Pre-proline 0 N--CA 1.453 -0.29 0 C-N-CA 123.493 0.717 . . . . 0.0 110.594 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.19 5.96 5.04 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 124.601 3.534 . . . . 0.0 112.616 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -128.05 -166.51 12.06 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 -174.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -141.34 172.97 11.95 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.715 0.806 . . . . 0.0 110.392 -177.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -139.75 10.21 2.43 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.07 0.548 . . . . 0.0 111.439 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -150.87 177.36 10.2 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.897 0.479 . . . . 0.0 110.553 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -144.85 20.97 1.63 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.484 0.713 . . . . 0.0 110.911 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -134.73 2.58 3.18 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.545 0.738 . . . . 0.0 111.623 -177.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -143.81 8.65 1.5 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.623 0.769 . . . . 0.0 110.246 176.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -152.94 171.76 17.83 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.331 1.052 . . . . 0.0 109.237 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 34.3 t -154.05 172.6 17.25 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.02 0.528 . . . . 0.0 110.348 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -138.96 7.79 2.49 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.785 0.834 . . . . 0.0 110.907 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt 51.42 -167.11 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.458 1.103 . . . . 0.0 112.234 -177.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 48.7 m -140.49 54.12 4.68 Favored Pre-proline 0 CA--C 1.53 0.178 0 C-N-CA 123.406 0.682 . . . . 0.0 111.139 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.81 176.58 8.06 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.767 2.978 . . . . 0.0 111.134 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -148.66 168.09 23.76 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.447 0.699 . . . . 0.0 110.406 179.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -155.58 153.66 30.49 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 30.9 m -145.25 -173.7 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 C-N-CA 123.897 0.879 . . . . 0.0 109.632 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mp0 -131.28 1.79 4.2 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.825 0.45 . . . . 0.0 111.697 -176.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 25.2 m 51.11 21.32 1.02 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.111 0.965 . . . . 0.0 113.43 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -139.6 6.97 2.3 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.63 0.772 . . . . 0.0 110.871 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -72.01 2.11 6.22 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.531 0.732 . . . . 0.0 111.527 177.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.412 ' HG2' ' H ' ' B' ' 28' ' ' MET . 43.0 ttm180 -58.28 143.0 46.13 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.685 0.794 . . . . 0.0 110.303 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -68.2 -8.97 43.49 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' MET . . . . . 0.412 ' H ' ' HG2' ' B' ' 26' ' ' ARG . 17.6 tpt -63.08 -25.76 68.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.908 0.322 . . . . 0.0 111.46 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.02 58.72 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.71 -16.04 62.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.238 -0.566 . . . . 0.0 111.014 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.12 -39.24 18.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.407 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 63.2 mt -74.43 -38.07 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.937 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -68.26 -33.69 74.83 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.175 -0.44 . . . . 0.0 110.471 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.5 t -66.24 -36.5 83.17 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.665 0.666 . . . . 0.0 110.622 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.65 -32.09 73.47 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.584 0.231 . . . . 0.0 111.014 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -97.96 -11.38 23.14 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 68.7 tp60 -71.36 -36.68 71.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 121.899 -0.501 . . . . 0.0 110.196 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -64.63 -24.35 67.56 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 120.311 -0.555 . . . . 0.0 110.835 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 13.1 m -70.17 -12.62 61.73 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 111.382 0.141 . . . . 0.0 111.382 174.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 67.6 mt -107.16 -18.05 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 O-C-N 121.96 -0.463 . . . . 0.0 110.785 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.51 26.64 0.1 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.575 0.75 . . . . 0.0 112.054 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -142.06 176.5 8.91 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.058 0.543 . . . . 0.0 111.151 -178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -63.35 175.31 1.01 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.865 0.866 . . . . 0.0 111.362 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.94 155.12 80.51 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 122.407 0.283 . . . . 0.0 110.481 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . 0.499 ' C ' ' H ' ' B' ' 47' ' ' GLU . 51.5 Cg_exo -54.79 -39.55 89.15 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.681 2.921 . . . . 0.0 114.952 -174.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.8 t70 51.37 -11.18 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.473 1.909 . . . . 0.0 115.286 -174.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.499 ' H ' ' C ' ' B' ' 45' ' ' PRO . 14.1 pt-20 -66.53 -16.51 64.2 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.131 -0.981 . . . . 0.0 111.65 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 29.6 mtm -73.3 -32.25 64.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.274 -0.266 . . . . 0.0 111.044 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -84.24 -12.27 55.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.793 -0.567 . . . . 0.0 110.018 173.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.21 -20.61 62.24 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.837 -0.539 . . . . 0.0 109.649 169.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 75.9 mt -78.55 -13.58 59.76 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.337 0.255 . . . . 0.0 110.406 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -88.13 -16.0 34.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -75.55 6.85 4.22 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.845 0.858 . . . . 0.0 111.675 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -127.66 9.77 6.53 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.732 0.813 . . . . 0.0 111.566 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 pp -145.21 -17.33 0.49 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.44 170.28 9.28 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.807 0.337 . . . . 0.0 110.78 173.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 47.5 tp -152.06 158.79 43.51 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -142.76 162.14 36.25 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.055 0.542 . . . . 0.0 109.771 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 22.5 tp -152.32 7.72 0.45 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 122.756 0.422 . . . . 0.0 110.896 -179.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.6 p -150.59 142.38 15.49 Favored Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.32 177.8 6.24 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.393 2.728 . . . . 0.0 111.351 176.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 . . . . . 0 CA--C 1.532 0.27 0 C-N-CA 124.59 1.156 . . . . 0.0 111.817 -177.647 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.2 ptm . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 120.366 0.127 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.9 t -154.15 164.71 38.07 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.867 0.467 . . . . 0.0 109.879 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.3 tp -59.22 -28.57 66.8 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.038 0.535 . . . . 0.0 110.967 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.45 -31.5 80.97 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.938 -0.465 . . . . 0.0 111.938 -178.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -77.17 1.42 18.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 122.719 0.408 . . . . 0.0 111.265 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -133.07 3.57 3.71 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.189 0.595 . . . . 0.0 110.695 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.6 tp -111.69 -41.1 4.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.542 0.337 . . . . 0.0 110.45 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.16 -45.23 99.88 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.86 -0.39 9.84 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.431 2.087 . . . . 0.0 112.774 -176.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -135.13 14.04 3.55 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 68.3 mt -54.33 -44.31 98.57 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.574 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -81.47 -10.01 12.25 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.07 1.847 . . . . 0.0 112.672 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.57 -24.52 66.36 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 118.646 0.657 . . . . 0.0 110.621 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.2 mt -67.4 -18.92 65.31 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.67 0.271 . . . . 0.0 110.442 176.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -98.81 -14.65 19.58 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.462 0.705 . . . . 0.0 110.276 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -16.24 53.78 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.438 0.695 . . . . 0.0 111.097 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -141.59 -21.02 0.74 Allowed 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.52 -23.24 77.76 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -71.87 -10.02 59.16 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 117.657 0.729 . . . . 0.0 111.647 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.08 6.1 5.39 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.74 0.416 . . . . 0.0 111.466 -177.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -91.95 -0.96 57.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.098 0.559 . . . . 0.0 110.437 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 t -151.37 -4.95 0.28 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.44 18.08 71.28 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.44 -0.788 . . . . 0.0 114.096 173.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 t -143.81 131.24 21.0 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 118.344 1.072 . . . . 0.0 110.16 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -74.67 -22.94 58.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.181 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.57 -35.53 58.13 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -73.88 -35.77 64.74 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.0 -36.57 86.38 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.64 -35.69 75.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.222 0.511 . . . . 0.0 111.323 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.8 24.07 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.753 -176.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -65.18 -35.98 82.79 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.295 0.952 . . . . 0.0 109.427 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 24.6 t -62.91 -53.52 45.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 C-N-CA 122.338 0.255 . . . . 0.0 110.687 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -71.58 -28.12 63.61 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.43 -175.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.02 -21.59 59.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 122.201 0.2 . . . . 0.0 110.748 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 m -66.37 -44.88 81.92 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -38.1 64.2 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.964 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -67.32 -14.56 63.03 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.803 -0.561 . . . . 0.0 110.923 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.4 0.4 56.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.324 0.65 . . . . 0.0 111.216 174.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 88.3 mt -123.57 -14.27 5.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 123.523 0.729 . . . . 0.0 111.358 -174.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -60.07 -4.79 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 121.503 -0.748 . . . . 0.0 112.964 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.3 2.1 8.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.024 0.53 . . . . 0.0 111.143 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.32 54.74 0.86 Allowed Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 123.651 0.781 . . . . 0.0 110.544 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.7 -13.04 36.83 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 123.435 2.757 . . . . 0.0 113.049 -174.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -74.99 -14.97 60.68 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.463 0.305 . . . . 0.0 111.213 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -77.74 -19.79 54.56 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.007 -0.433 . . . . 0.0 111.016 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.46 114.55 52.33 Favored Pre-proline 0 N--CA 1.452 -0.345 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.87 155.09 71.12 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.526 2.151 . . . . 0.0 110.986 -176.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -136.8 12.85 3.15 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.771 0.828 . . . . 0.0 110.772 -174.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -134.73 27.93 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.343 0.657 . . . . 0.0 111.041 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.6 m -134.76 179.15 4.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 123.828 0.851 . . . . 0.0 109.207 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -54.43 146.72 31.79 Favored Pre-proline 0 CA--C 1.531 0.212 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -70.79 9.71 0.73 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.826 3.017 . . . . 0.0 111.722 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -129.37 -16.88 3.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.5 0.72 . . . . 0.0 110.933 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.8 tp -78.84 -34.17 45.37 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.165 0.439 . . . . 0.0 110.303 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.64 -31.28 60.79 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.54 -47.67 77.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -74.75 -30.0 61.34 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 119.698 -0.191 . . . . 0.0 111.485 -177.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -63.05 -45.91 89.99 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 118.382 0.537 . . . . 0.0 110.605 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 92.9 mmm -73.54 -31.3 63.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.829 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.37 -37.9 74.65 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.036 0.38 . . . . 0.0 111.016 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -65.71 -24.82 67.07 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.29 -37.22 63.24 Favored Glycine 0 C--N 1.339 0.721 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.5 mm -73.19 -39.93 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 CA-C-N 117.709 0.755 . . . . 0.0 110.432 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -68.27 -33.64 74.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.293 -0.254 . . . . 0.0 111.122 -177.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.32 -31.54 68.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 117.78 0.264 . . . . 0.0 110.433 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.2 t -75.97 -26.1 56.46 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.146 0.178 . . . . 0.0 110.835 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.58 -36.79 68.26 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.382 0.273 . . . . 0.0 110.991 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -77.15 -22.81 52.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.55 3.64 18.21 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.259 0.624 . . . . 0.0 111.747 177.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -138.86 2.91 2.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.846 0.458 . . . . 0.0 111.242 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.43 26.62 72.95 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 119.684 -0.509 . . . . 0.0 113.133 175.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.63 -10.15 17.3 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.164 0.982 . . . . 0.0 112.249 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.65 158.5 38.42 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.057 0.543 . . . . 0.0 110.363 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -144.52 5.73 1.23 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.344 0.657 . . . . 0.0 110.769 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.0 t -156.69 178.09 10.73 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.071 0.548 . . . . 0.0 109.956 -177.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.5 p -145.43 17.24 1.51 Allowed 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.528 0.731 . . . . 0.0 110.619 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -56.42 150.32 15.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.11 0.564 . . . . 0.0 110.278 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -144.84 -176.27 5.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.22 0.608 . . . . 0.0 109.855 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -141.21 13.12 2.2 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.782 0.433 . . . . 0.0 111.697 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.82 156.92 13.2 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.062 -0.398 . . . . 0.0 110.835 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.42 -11.94 59.91 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -175.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 156.19 26.04 0.03 OUTLIER Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.305 -0.719 . . . . 0.0 113.787 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.7 t -138.05 13.48 2.86 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.602 1.201 . . . . 0.0 112.111 -177.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -155.16 -50.04 0.09 Allowed 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -20.75 64.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.477 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.56 -29.96 47.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 122.465 0.306 . . . . 0.0 110.828 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.23 -2.05 54.63 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.822 0.449 . . . . 0.0 111.564 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -116.04 -44.62 2.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.58 0.352 . . . . 0.0 110.776 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.7 -1.61 1.99 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 82.6 mtt-85 -120.82 -15.38 8.36 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.424 0.69 . . . . 0.0 111.516 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -134.32 28.23 3.73 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.909 0.884 . . . . 0.0 110.626 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.88 1.07 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -130.85 0.29 4.29 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.641 0.655 . . . . 0.0 112.097 -175.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.7 ttm -59.14 152.02 21.35 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.6 m -53.46 137.76 50.69 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 123.172 0.589 . . . . 0.0 110.548 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.95 -5.43 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 125.083 3.855 . . . . 0.0 115.9 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 21.7 tp -133.57 -23.49 1.84 Allowed 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 111.898 -178.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 48.2 m -68.74 -24.7 64.49 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.639 0.654 . . . . 0.0 109.878 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 69.3 ttt-85 -73.07 -27.78 61.93 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -78.27 -35.24 48.35 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.84 74.59 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.3 tp -65.76 -49.78 67.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.395 0.278 . . . . 0.0 110.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.26 -4.55 33.81 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.1 tp -106.15 -4.59 20.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.09 0.556 . . . . 0.0 111.72 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 77.3 p -140.06 3.28 1.98 Allowed 'General case' 0 C--N 1.34 0.189 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.52 6.2 4.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.324 0.511 . . . . 0.0 112.147 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 1.4 mtm -127.38 -7.7 5.81 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.927 0.491 . . . . 0.0 111.887 176.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -150.65 -22.9 0.23 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.744 0.702 . . . . 0.0 112.103 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 79.05 28.05 54.87 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.218 -0.768 . . . . 0.0 113.426 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -51.25 149.22 4.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.275 1.037 . . . . 0.0 110.659 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.0 m -62.16 152.54 77.99 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.78 -17.02 37.73 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.996 2.464 . . . . 0.0 111.945 -176.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -78.98 -41.34 29.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.029 0.377 . . . . 0.0 110.368 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -78.7 -30.51 46.05 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.49 -25.36 64.93 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 175.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.05 -27.75 35.61 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.125 0.17 . . . . 0.0 110.757 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -70.45 -33.42 71.27 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.036 0.535 . . . . 0.0 111.628 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 77.7 mt -74.02 -4.29 34.46 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 28.6 pt -135.92 9.22 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 118.306 0.503 . . . . 0.0 110.978 177.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 50.08 61.04 3.39 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.136 1.374 . . . . 0.0 113.935 178.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 22.3 m -134.69 -175.51 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 C-N-CA 123.854 0.862 . . . . 0.0 109.792 175.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -89.65 159.66 17.02 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -56.51 -39.11 72.75 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 122.565 0.346 . . . . 0.0 111.416 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.2 m -70.82 -20.57 62.55 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.868 0.467 . . . . 0.0 112.034 -177.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -73.98 -40.7 62.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.5 t -63.45 -38.22 81.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.12 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -60.56 -38.44 84.55 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.48 0.181 . . . . 0.0 110.856 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.3 m -76.12 -37.71 57.75 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.905 -0.134 . . . . 0.0 110.772 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.82 -34.09 77.04 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.415 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 m -81.34 -28.44 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 CA-C-N 118.452 0.569 . . . . 0.0 111.028 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 55.4 m -66.22 -40.52 90.36 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.49 -28.16 56.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.4 -44.11 65.56 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.344 -0.222 . . . . 0.0 111.246 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.61 -22.83 59.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 O-C-N 122.15 -0.344 . . . . 0.0 111.026 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.17 -42.63 72.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.611 0.187 . . . . 0.0 110.935 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -77.75 -17.8 57.17 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.151 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.5 mm -73.94 -53.93 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 173.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.43 -17.12 63.62 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -173.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -85.69 -10.84 55.06 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.452 ' HG3' ' H ' ' A' ' 142' ' ' ARG . 18.8 pt20 -156.69 -36.35 0.08 Allowed 'General case' 0 C--N 1.339 0.145 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -176.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 43.0 p 44.39 19.43 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.341 1.056 . . . . 0.0 112.852 -169.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.452 ' H ' ' HG3' ' A' ' 140' ' ' GLN . 34.6 mtp-105 -147.86 168.0 23.34 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.036 0.935 . . . . 0.0 110.357 -171.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -151.3 13.29 0.66 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.083 0.553 . . . . 0.0 110.684 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.8 -9.34 58.55 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.275 0.63 . . . . 0.0 112.427 -174.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -150.94 2.7 0.44 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.629 0.65 . . . . 0.0 112.65 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -155.8 165.27 37.0 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.835 0.454 . . . . 0.0 110.566 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 21.1 m -148.28 158.79 40.7 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 123.23 0.612 . . . . 0.0 109.76 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -51.17 177.51 0.04 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 1 C-N-CA 125.522 4.148 . . . . 0.0 113.432 169.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 17.8 ptm180 -143.47 178.84 7.49 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 123.056 0.542 . . . . 0.0 110.744 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -163.41 -174.45 33.29 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 82.8 p -145.83 11.14 1.23 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.625 0.37 . . . . 0.0 111.872 -177.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 56.0 p-80 -61.64 165.34 5.12 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 122.913 0.485 . . . . 0.0 110.885 178.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . 0.419 ' CG ' ' H ' ' A' ' 154' ' ' HIS . 1.8 t60 -152.84 179.12 8.94 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.577 0.351 . . . . 0.0 110.322 -177.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . 0.419 ' H ' ' CG ' ' A' ' 153' ' ' HIS . 53.5 m80 -138.37 16.98 2.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.373 0.669 . . . . 0.0 111.354 -176.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . 0.418 ' CG ' ' H ' ' A' ' 156' ' ' HIS . 24.6 t60 -145.26 172.63 12.86 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.162 0.585 . . . . 0.0 109.542 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . 0.418 ' H ' ' CG ' ' A' ' 155' ' ' HIS . 63.3 m80 -143.67 -178.8 6.08 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 122.99 0.516 . . . . 0.0 110.874 -173.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.027 -1.464 . . . . 0.0 110.009 -178.326 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.604 ' HG3' ' H ' ' B' ' 2' ' ' LEU . 14.7 ptm . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.285 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . 0.604 ' H ' ' HG3' ' B' ' 1' ' ' MET . 2.3 pt? -153.1 8.87 0.42 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.181 0.9 . . . . 0.0 112.555 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -151.06 168.92 23.13 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.935 0.494 . . . . 0.0 110.594 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -129.33 156.24 78.75 Favored Pre-proline 0 CA--C 1.531 0.244 0 C-N-CA 124.038 0.935 . . . . 0.0 109.014 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.96 171.2 17.12 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 123.48 2.787 . . . . 0.0 110.957 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -166.59 3.69 0.05 OUTLIER Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.918 -0.379 . . . . 0.0 112.742 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -72.52 -2.51 19.98 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 117.691 0.746 . . . . 0.0 111.59 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -151.01 152.66 33.82 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.456 0.702 . . . . 0.0 109.216 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -151.88 20.43 0.69 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.644 0.377 . . . . 0.0 111.297 -176.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -59.86 146.68 41.15 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.971 0.509 . . . . 0.0 111.102 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -142.56 22.8 1.98 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.414 1.086 . . . . 0.0 110.462 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.21 9.84 0.76 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.891 1.276 . . . . 0.0 113.579 -177.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 32.4 t -158.27 150.18 21.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 176.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 46.6 m 47.57 16.47 0.07 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.013 1.325 . . . . 0.0 114.103 -177.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -144.68 24.3 1.54 Allowed 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.153 0.981 . . . . 0.0 110.147 -176.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -142.24 168.33 19.98 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 123.181 0.592 . . . . 0.0 110.824 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 49.5 m -146.99 54.61 2.07 Favored Pre-proline 0 CA--C 1.532 0.278 0 C-N-CA 123.288 0.635 . . . . 0.0 111.582 -176.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.85 171.47 14.49 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.427 2.751 . . . . 0.0 110.912 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -151.7 174.77 13.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.96 0.504 . . . . 0.0 110.555 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.83 11.92 1.26 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.133 0.573 . . . . 0.0 112.156 -178.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 47.2 t -62.81 -18.8 21.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 123.213 0.605 . . . . 0.0 110.841 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -152.32 164.33 37.66 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.164 0.585 . . . . 0.0 109.837 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.2 m -150.52 175.8 11.55 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 123.46 0.704 . . . . 0.0 110.221 -178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -141.53 158.55 43.7 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 123.686 0.795 . . . . 0.0 109.452 178.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -152.65 11.75 0.51 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.543 0.337 . . . . 0.0 111.726 -177.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 149.58 10.66 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 122.775 0.43 . . . . 0.0 111.869 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -153.6 16.6 0.52 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.276 0.63 . . . . 0.0 111.013 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.61 -26.91 62.23 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.098 0.559 . . . . 0.0 112.269 -175.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.93 -42.52 96.84 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.32 -20.44 62.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 122.507 -0.408 . . . . 0.0 110.772 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.59 -36.53 70.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.74 -37.43 67.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -66.48 -32.63 74.11 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.563 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 57.8 m -66.6 -42.11 87.44 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.651 0.659 . . . . 0.0 110.74 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -24.5 64.95 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -107.73 -13.63 14.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -175.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -68.66 -31.26 70.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 170.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -57.5 -37.07 72.37 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 175.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.4 m -68.41 -12.58 61.36 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.416 ' C ' ' H ' ' B' ' 42' ' ' GLU . 46.6 mm -105.9 -16.02 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.803 -0.561 . . . . 0.0 111.259 -178.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.92 28.62 0.17 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.252 0.621 . . . . 0.0 110.646 175.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' B' ' 40' ' ' ILE . 81.4 mm-40 -134.32 173.66 11.38 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.225 0.61 . . . . 0.0 111.309 -174.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -69.12 179.01 2.05 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.023 0.929 . . . . 0.0 110.89 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.4 m -136.82 155.01 76.73 Favored Pre-proline 0 C--O 1.233 0.234 0 C-N-CA 123.376 0.67 . . . . 0.0 110.41 -178.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -77.25 178.74 7.26 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.691 2.927 . . . . 0.0 110.531 176.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -145.99 -0.44 0.8 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.985 0.514 . . . . 0.0 110.929 175.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.15 -24.64 67.46 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 122.912 0.485 . . . . 0.0 112.242 -177.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 53.4 mtm -74.81 -32.78 62.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 122.225 -0.297 . . . . 0.0 110.788 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.71 -12.65 55.56 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.28 -20.44 61.51 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 69.9 mt -71.0 -18.35 62.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.181 -0.324 . . . . 0.0 110.337 172.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 18.5 mt -84.94 -19.15 32.63 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.728 173.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -73.14 8.19 1.76 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.932 0.333 . . . . 0.0 111.039 176.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -130.37 12.96 5.54 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.813 0.845 . . . . 0.0 109.986 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.1 mt -131.47 -26.36 2.06 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 123.568 0.747 . . . . 0.0 111.784 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.19 151.97 11.6 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.016 0.371 . . . . 0.0 110.511 171.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 39.1 tp -154.38 163.71 39.74 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.195 -0.316 . . . . 0.0 110.605 -176.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -63.41 169.23 3.87 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.101 0.56 . . . . 0.0 111.133 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 94.8 mt -142.49 172.52 12.58 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.951 0.9 . . . . 0.0 110.165 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 14.5 p -150.02 140.1 13.74 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.31 171.59 16.63 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 123.268 2.645 . . . . 0.0 111.165 178.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 . . . . . 0 N--CA 1.454 -0.245 0 C-N-CA 123.419 0.687 . . . . 0.0 110.117 -179.592 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.436 ' HG2' ' H ' ' A' ' 3' ' ' LEU . 55.8 ttm . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.8 p -141.41 20.31 2.22 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.475 0.71 . . . . 0.0 110.885 -178.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.436 ' H ' ' HG2' ' A' ' 1' ' ' MET . 49.2 tp -56.72 -33.36 66.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.669 0.788 . . . . 0.0 111.901 -178.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.61 -35.08 91.5 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 121.69 -0.631 . . . . 0.0 112.051 -176.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -74.33 3.17 7.77 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.747 0.819 . . . . 0.0 110.94 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.3 mm-40 -131.81 -1.93 3.74 Favored 'General case' 0 N--CA 1.458 -0.059 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 tt -111.37 -43.05 3.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.125 0.57 . . . . 0.0 110.624 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.57 -45.2 99.53 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -75.04 2.26 6.85 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.264 1.976 . . . . 0.0 113.16 -176.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -130.85 9.92 5.0 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.777 0.431 . . . . 0.0 112.02 -177.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -56.6 -42.35 95.83 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.81 -7.53 14.48 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.922 1.748 . . . . 0.0 112.58 -173.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -71.61 -19.86 62.06 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.542 0.61 . . . . 0.0 111.945 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.8 mp -77.18 -23.36 51.54 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.815 -0.553 . . . . 0.0 110.886 -178.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -101.78 -15.56 16.9 Favored 'General case' 0 C--O 1.228 -0.027 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -52.48 -27.66 17.15 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.711 1.205 . . . . 0.0 110.884 175.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -137.42 -13.54 1.54 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.568 0.347 . . . . 0.0 111.241 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.44 -34.95 87.51 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 47.2 tpt85 -65.44 -20.88 66.55 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.1 0.95 . . . . 0.0 111.369 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.92 -3.6 55.76 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.824 0.45 . . . . 0.0 110.906 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mp -111.56 7.77 20.72 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.956 0.902 . . . . 0.0 111.141 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.1 p -140.46 -22.43 0.82 Allowed 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.43 8.73 60.04 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-O 119.558 -0.579 . . . . 0.0 112.673 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.5 t -154.51 138.12 16.04 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.331 1.065 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -72.5 -23.19 60.99 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.438 -0.164 . . . . 0.0 110.821 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -70.33 -39.06 74.96 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.314 -0.241 . . . . 0.0 110.562 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -82.2 -32.07 30.04 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.07 -43.55 90.27 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -72.5 -29.4 63.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 117.341 0.57 . . . . 0.0 110.817 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 tmmm? -70.7 -44.04 67.77 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.882 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -64.67 -31.9 73.33 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.129 0.422 . . . . 0.0 110.91 179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.4 t -62.08 -52.75 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 117.995 0.361 . . . . 0.0 110.935 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -76.59 -26.77 55.38 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.358 -176.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.38 -24.98 61.34 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.284 0.234 . . . . 0.0 110.503 176.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 66.3 m -65.98 -40.15 90.96 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 175.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 -46.64 65.6 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -59.62 -25.32 64.56 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.902 0.481 . . . . 0.0 111.695 -178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.88 1.0 32.69 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.132 0.573 . . . . 0.0 111.617 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.4 mt -123.8 -16.01 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 123.766 0.826 . . . . 0.0 110.561 -176.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.5 t -59.59 -13.92 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.181 0.592 . . . . 0.0 111.641 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 3.74 9.67 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.063 0.545 . . . . 0.0 111.298 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.31 55.73 1.23 Allowed Pre-proline 0 N--CA 1.452 -0.346 0 C-N-CA 122.935 0.494 . . . . 0.0 110.608 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.45 -8.84 20.21 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.109 2.54 . . . . 0.0 112.173 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -78.7 -6.66 56.38 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.903 0.481 . . . . 0.0 110.791 174.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -99.49 8.51 44.46 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.511 0.725 . . . . 0.0 110.774 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -134.23 62.06 53.98 Favored Pre-proline 0 CA--C 1.533 0.317 0 C-N-CA 123.064 0.546 . . . . 0.0 109.976 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.78 163.69 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.701 3.601 . . . . 0.0 114.849 -175.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.41 8.99 10.24 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.49 1.116 . . . . 0.0 109.506 177.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -76.08 5.25 6.98 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.168 0.987 . . . . 0.0 111.891 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.3 m -136.68 -179.2 2.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.991 0.916 . . . . 0.0 109.347 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.533 ' C ' ' H ' ' A' ' 53' ' ' ARG . 1.8 m-20 -54.46 147.03 30.69 Favored Pre-proline 0 N--CA 1.455 -0.219 0 O-C-N 122.388 -0.195 . . . . 0.0 110.546 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -71.44 18.54 0.27 Allowed 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 124.148 3.232 . . . . 0.0 110.528 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.533 ' H ' ' C ' ' A' ' 51' ' ' ASP . 86.6 mtm180 -131.51 -30.38 1.68 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.001 0.92 . . . . 0.0 110.99 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 62.1 tp -72.01 -39.42 69.22 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.682 0.219 . . . . 0.0 110.588 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.68 -29.83 62.84 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.68 -40.9 97.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.63 0.372 . . . . 0.0 110.075 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.54 -27.67 41.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -68.56 -41.45 79.73 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.358 -0.214 . . . . 0.0 110.838 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 98.4 mmm -81.71 -31.24 32.2 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.796 -0.145 . . . . 0.0 110.888 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.4 -37.39 83.04 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -71.87 -24.26 61.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.54 -37.69 93.94 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.8 mm -73.78 -35.47 43.49 Favored 'Isoleucine or valine' 0 C--N 1.338 0.104 0 CA-C-N 117.892 0.846 . . . . 0.0 109.882 176.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -65.9 -37.41 86.03 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.92 -30.27 67.64 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.305 -0.247 . . . . 0.0 110.832 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.3 t -74.89 -28.83 60.79 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 110.618 -0.141 . . . . 0.0 110.618 178.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.54 -31.11 65.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.097 -0.377 . . . . 0.0 110.709 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -83.01 -12.55 57.16 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.539 0.336 . . . . 0.0 110.705 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.9 5.84 49.91 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.351 0.66 . . . . 0.0 111.124 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -137.53 0.48 2.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.005 0.522 . . . . 0.0 111.133 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.67 6.21 89.11 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.732 -0.482 . . . . 0.0 113.323 176.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -66.49 -20.0 65.93 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.985 0.892 . . . . 0.0 110.621 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.99 153.11 29.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.818 0.847 . . . . 0.0 109.688 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -147.61 -0.59 0.64 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.735 0.414 . . . . 0.0 111.958 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.5 t -160.61 175.47 12.64 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.155 0.434 . . . . 0.0 110.436 -177.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.4 p -153.0 159.82 42.95 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.489 0.715 . . . . 0.0 110.121 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -160.91 177.03 10.78 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.277 0.631 . . . . 0.0 109.482 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.0 m -141.64 155.43 45.71 Favored 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 123.296 0.638 . . . . 0.0 109.314 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -152.09 14.04 0.61 Allowed 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -173.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.56 165.97 2.66 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.057 0.456 . . . . 0.0 111.223 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.37 -10.88 55.46 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.52 21.23 0.03 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.949 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.7 t -137.11 6.44 2.85 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.715 1.257 . . . . 0.0 112.742 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -143.92 -36.01 0.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.02 -25.63 66.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.6 -24.56 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 122.567 0.347 . . . . 0.0 110.517 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.06 -1.4 56.79 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.859 0.463 . . . . 0.0 111.814 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -130.41 -16.07 3.53 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 117.804 0.275 . . . . 0.0 111.625 175.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.07 -1.54 32.89 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.771 0.259 . . . . 0.0 110.566 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -130.55 -8.54 4.11 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.585 0.754 . . . . 0.0 112.034 -177.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.8 mt -139.58 12.9 2.53 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -170.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.54 5.45 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -130.29 3.73 4.73 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 119.12 0.873 . . . . 0.0 112.642 -173.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 52.9 ttm -67.09 158.99 29.77 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 98.0 m -59.01 138.08 87.71 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 122.89 0.476 . . . . 0.0 109.944 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.0 -7.87 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 125.19 3.927 . . . . 0.0 116.335 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.1 tp -131.73 -22.29 2.4 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 119.002 0.819 . . . . 0.0 111.814 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.4 m -66.99 -19.18 65.67 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.929 -0.482 . . . . 0.0 110.059 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -65.87 -34.13 77.43 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.649 0.38 . . . . 0.0 110.25 175.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -80.7 -34.69 34.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.27 -32.38 74.01 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.966 -0.459 . . . . 0.0 109.794 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.71 -46.14 73.08 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.004 0.522 . . . . 0.0 110.78 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -74.94 -6.65 50.37 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.353 0.524 . . . . 0.0 111.445 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 74.9 mt -99.79 -6.29 27.19 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.767 0.427 . . . . 0.0 112.0 176.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -135.08 4.72 3.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.488 0.585 . . . . 0.0 112.551 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.96 7.93 1.86 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.49 0.316 . . . . 0.0 111.383 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.1 mtm -141.98 1.83 1.49 Allowed 'General case' 0 C--N 1.338 0.087 0 C-N-CA 123.487 0.715 . . . . 0.0 111.87 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -149.43 -17.93 0.28 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.628 0.649 . . . . 0.0 112.187 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 72.51 10.85 76.15 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 119.282 -0.732 . . . . 0.0 113.401 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -59.73 148.21 35.02 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.819 1.309 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.2 m -70.06 152.51 95.8 Favored Pre-proline 0 N--CA 1.452 -0.333 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.29 -24.08 25.75 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.208 2.605 . . . . 0.0 113.206 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.05 -34.6 66.39 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.611 0.364 . . . . 0.0 111.343 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -79.68 -38.28 33.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.87 -24.68 65.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.729 -0.177 . . . . 0.0 111.124 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.4 -39.11 65.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.958 0.345 . . . . 0.0 110.507 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -67.38 -26.11 66.3 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.597 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 18.4 tp -83.47 -6.2 59.39 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -176.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 15.7 pt -135.46 11.99 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.645 0.657 . . . . 0.0 111.435 176.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 56.81 53.71 7.95 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.186 0.994 . . . . 0.0 113.524 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 28.2 m -136.38 178.61 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 123.443 0.697 . . . . 0.0 110.058 176.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -80.44 157.67 26.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 46.5 m -60.35 -34.4 73.79 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.9 -0.5 . . . . 0.0 110.818 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 84.0 p -72.28 -21.36 61.37 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 122.377 -0.202 . . . . 0.0 111.46 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -74.39 -36.36 63.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.2 t -64.05 -37.69 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.71 -33.23 73.65 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.2 m -77.31 -38.28 50.89 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 122.341 -0.224 . . . . 0.0 110.795 177.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.2 -35.61 80.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.128 0.422 . . . . 0.0 111.429 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.5 m -76.42 -27.65 17.54 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 118.805 0.73 . . . . 0.0 110.716 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.3 m -67.43 -35.76 79.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -81.15 -25.06 37.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.77 -47.34 66.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.51 -22.43 61.79 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.818 -0.135 . . . . 0.0 110.966 179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.51 -36.7 68.42 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -72.85 -25.11 60.99 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 117.668 0.213 . . . . 0.0 110.605 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 20.2 mm -72.83 -54.62 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -61.54 -21.68 64.48 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.614 0.366 . . . . 0.0 111.685 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -72.23 -24.58 61.41 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -177.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -154.46 -53.52 0.1 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -169.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 22.7 p 46.66 6.24 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -171.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.4 8.91 0.28 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 121.449 1.931 . . . . 0.0 114.441 178.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -142.39 174.26 10.78 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -174.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -148.34 8.48 0.81 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.132 0.973 . . . . 0.0 110.869 177.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -140.55 21.06 2.37 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.3 1.04 . . . . 0.0 109.953 -179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 40.8 tp -57.32 155.66 8.7 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.169 0.588 . . . . 0.0 110.991 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 16.9 m -141.41 158.61 63.26 Favored Pre-proline 0 N--CA 1.456 -0.127 0 C-N-CA 123.746 0.818 . . . . 0.0 110.03 -176.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.3 -179.54 2.77 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 123.833 3.022 . . . . 0.0 110.755 176.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -137.82 15.72 2.88 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.451 0.701 . . . . 0.0 111.386 -177.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -170.68 -175.3 39.26 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 47.6 m -143.61 174.54 10.69 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.121 0.569 . . . . 0.0 110.208 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 33.6 t-80 -149.06 161.36 42.11 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 122.859 0.464 . . . . 0.0 110.25 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -147.96 175.11 11.25 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.461 0.704 . . . . 0.0 110.474 -176.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -136.3 7.08 3.09 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.156 0.582 . . . . 0.0 111.002 -179.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -156.21 152.74 28.18 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.578 0.751 . . . . 0.0 109.186 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 30.1 p80 -157.8 -5.11 0.09 Allowed 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 85.3 t60 . . . . . 0 C--O 1.251 1.171 0 CA-C-O 117.355 -1.307 . . . . 0.0 110.708 -178.179 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 110.652 -0.129 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.9 -3.82 24.66 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.914 0.485 . . . . 0.0 110.83 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -150.0 174.78 12.33 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.983 0.913 . . . . 0.0 109.816 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 96.7 mt -140.17 159.85 62.38 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 123.329 0.651 . . . . 0.0 110.191 -178.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -53.75 170.67 0.4 Allowed 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 124.834 3.689 . . . . 0.0 114.067 177.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . 0.404 ' C ' ' H ' ' B' ' 8' ' ' LYS . . . -139.74 4.26 2.7 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.688 178.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -77.64 33.49 0.17 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.914 0.886 . . . . 0.0 110.717 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.404 ' H ' ' C ' ' B' ' 6' ' ' GLY . 22.6 pttp -134.77 -5.08 2.48 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.675 0.79 . . . . 0.0 111.547 -174.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -158.17 179.91 8.72 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.217 0.607 . . . . 0.0 109.527 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -141.55 12.04 2.11 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.172 0.589 . . . . 0.0 110.971 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -144.13 7.9 1.4 Allowed 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -174.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.36 9.01 1.4 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.534 0.606 . . . . 0.0 112.318 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 9.5 t -154.98 -168.76 2.98 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.89 0.476 . . . . 0.0 110.115 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 33.0 t -139.68 170.81 15.21 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.865 0.866 . . . . 0.0 109.857 -178.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -139.1 -8.94 1.32 Allowed 'General case' 0 CA--C 1.528 0.1 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm 44.37 43.47 6.12 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.66 0.784 . . . . 0.0 111.801 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 77.7 p -132.24 61.5 57.87 Favored Pre-proline 0 CA--C 1.533 0.297 0 C-N-CA 123.233 0.613 . . . . 0.0 111.738 -174.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.68 -175.71 0.99 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.931 3.087 . . . . 0.0 110.89 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . 56.84 21.55 6.17 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.079 0.951 . . . . 0.0 112.497 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 22.1 tptm -76.18 63.85 1.92 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.835 0.854 . . . . 0.0 111.313 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 34.5 m -59.87 178.85 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 123.994 0.917 . . . . 0.0 112.019 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -133.22 12.07 4.21 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.791 0.436 . . . . 0.0 111.644 -174.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.8 p -148.89 165.33 31.85 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 122.988 0.515 . . . . 0.0 110.459 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -147.98 -176.3 5.22 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.634 0.774 . . . . 0.0 110.236 -177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 26.9 t70 55.3 25.36 7.39 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.217 1.007 . . . . 0.0 112.543 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -150.17 173.06 14.34 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.813 0.445 . . . . 0.0 110.838 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -144.86 20.01 1.63 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.214 0.606 . . . . 0.0 111.44 -176.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.6 tpt -55.03 -26.76 39.49 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.925 0.49 . . . . 0.0 112.166 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.25 -40.62 60.8 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.74 -20.3 62.65 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.565 -0.374 . . . . 0.0 110.514 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.4 -37.36 63.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 42.0 mt -77.5 -40.13 43.92 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.521 0.328 . . . . 0.0 110.302 177.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.46 -34.35 77.73 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.203 -0.311 . . . . 0.0 110.747 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 44.2 t -71.59 -37.36 70.99 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.092 0.405 . . . . 0.0 110.851 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.43 -23.87 65.58 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.247 0.219 . . . . 0.0 110.968 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -104.81 -11.75 16.63 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.146 -0.346 . . . . 0.0 111.289 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.0 -36.27 82.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -62.32 -35.76 80.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.654 0.381 . . . . 0.0 110.816 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 56.3 m -66.41 -11.82 53.72 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.548 0.574 . . . . 0.0 112.548 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 35.3 pt -129.4 13.16 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.926 -0.484 . . . . 0.0 111.545 -176.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.72 23.53 0.13 Allowed 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.599 0.76 . . . . 0.0 112.188 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.08 -178.53 5.75 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.753 -0.592 . . . . 0.0 111.826 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -63.74 -177.62 0.25 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.386 1.074 . . . . 0.0 112.503 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -134.3 156.62 78.81 Favored Pre-proline 0 CA--C 1.53 0.175 0 C-N-CA 123.466 0.707 . . . . 0.0 110.276 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.7 178.97 6.7 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 123.1 2.533 . . . . 0.0 110.622 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -146.47 -0.43 0.75 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.291 0.236 . . . . 0.0 111.456 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -63.01 -24.53 67.96 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.165 -0.334 . . . . 0.0 111.709 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.1 mtm -72.85 -29.8 63.49 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.217 0.207 . . . . 0.0 111.328 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.5 -14.37 43.28 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.1 -20.48 61.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.33 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.54 ' C ' ' H ' ' B' ' 54' ' ' LYS . 22.1 mt -76.69 -15.42 59.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 119.679 -0.201 . . . . 0.0 111.099 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -69.02 16.7 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.331 0.514 . . . . 0.0 111.13 173.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.54 ' H ' ' C ' ' B' ' 52' ' ' LEU . 53.7 mtmt -117.2 -3.77 11.47 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.456 1.102 . . . . 0.0 111.219 176.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -157.58 0.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -135.31 24.22 3.49 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.281 0.632 . . . . 0.0 111.529 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -139.91 134.08 31.1 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -150.0 167.83 25.6 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 123.451 0.7 . . . . 0.0 110.138 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.4 mt -141.0 15.12 2.27 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.48 0.712 . . . . 0.0 111.81 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 52.8 t -138.48 135.96 18.59 Favored Pre-proline 0 C--O 1.233 0.192 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.65 160.59 48.93 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 123.191 2.594 . . . . 0.0 111.523 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 41.0 ptt85 . . . . . 0 CA--C 1.528 0.097 0 C-N-CA 123.919 0.888 . . . . 0.0 110.238 -179.111 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.476 0.847 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.5 m 51.1 20.56 0.87 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.482 1.113 . . . . 0.0 113.54 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 42.3 tp -62.54 -27.27 69.05 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.111 -0.368 . . . . 0.0 110.687 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.46 -18.93 79.97 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-O 119.685 -0.508 . . . . 0.0 112.333 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -74.61 -2.31 25.44 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 117.984 0.892 . . . . 0.0 111.636 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -134.31 -21.37 1.82 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.18 0.592 . . . . 0.0 111.233 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.4 tp -75.59 -37.44 59.84 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.151 -0.343 . . . . 0.0 110.879 175.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.18 -46.75 99.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -173.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -73.0 -3.47 13.69 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.523 2.149 . . . . 0.0 112.968 -177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -129.22 11.11 5.89 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.311 0.505 . . . . 0.0 111.932 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.62 -46.26 99.85 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.21 -9.58 12.67 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 121.995 1.796 . . . . 0.0 112.427 -171.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.5 -32.52 73.45 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.505 0.593 . . . . 0.0 110.651 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.3 -18.22 61.81 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 122.368 -0.207 . . . . 0.0 111.047 -177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.6 mtm180 -98.88 -20.52 16.78 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.029 0.377 . . . . 0.0 110.773 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -61.42 -22.38 64.95 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 117.781 0.264 . . . . 0.0 110.74 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -130.34 -13.74 3.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.768 0.427 . . . . 0.0 110.876 175.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.19 73.82 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -68.17 -19.83 64.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 117.642 0.721 . . . . 0.0 111.052 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -100.93 4.3 42.47 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.623 0.769 . . . . 0.0 112.28 -175.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 59.9 mt -110.23 5.89 22.16 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.4 t -154.18 -20.43 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.964 0.802 . . . . 0.0 113.133 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.64 2.95 53.03 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 118.892 0.769 . . . . 0.0 114.225 174.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -154.82 146.31 23.11 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.658 1.229 . . . . 0.0 111.235 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -77.64 -17.92 57.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.926 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -70.92 -31.02 67.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -82.73 -32.57 27.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.798 0.439 . . . . 0.0 110.398 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.23 -39.94 81.99 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.33 -28.39 61.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.321 0.561 . . . . 0.0 110.4 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -69.26 -42.85 75.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.63 -42.14 95.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.217 -0.42 . . . . 0.0 111.656 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.7 m -67.64 -39.78 82.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.13 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -77.15 -29.26 54.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.515 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.03 -27.12 61.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.1 m -65.64 -40.48 92.56 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -40.92 26.26 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 121.082 -0.247 . . . . 0.0 111.068 -175.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -65.19 -24.65 67.43 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.221 -178.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.54 -1.16 23.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.267 0.627 . . . . 0.0 111.516 175.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 82.0 mt -118.14 -15.72 8.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.006 0.922 . . . . 0.0 109.763 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.18 -9.88 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.388 0.675 . . . . 0.0 111.333 175.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.2 -0.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.393 0.677 . . . . 0.0 110.898 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.21 57.51 1.49 Allowed Pre-proline 0 N--CA 1.452 -0.364 0 C-N-CA 123.29 0.636 . . . . 0.0 110.941 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -65.12 -11.0 27.85 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.086 2.524 . . . . 0.0 112.237 -177.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.17 -17.63 62.53 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.575 0.35 . . . . 0.0 110.653 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -83.3 0.8 44.13 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.999 0.52 . . . . 0.0 111.197 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -132.61 69.34 79.64 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.63 177.93 5.0 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 125.014 3.809 . . . . 0.0 112.197 -173.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 43.0 mmm-85 -123.56 7.09 8.89 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.727 0.811 . . . . 0.0 109.999 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -78.67 10.56 3.15 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.375 1.07 . . . . 0.0 111.844 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.47 171.85 16.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 C-N-CA 123.64 0.776 . . . . 0.0 109.843 -179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.413 ' C ' ' H ' ' A' ' 53' ' ' ARG . 10.5 m-20 -58.96 152.01 52.35 Favored Pre-proline 0 N--CA 1.453 -0.28 0 C-N-CA 122.605 0.362 . . . . 0.0 110.495 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -71.38 12.94 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.171 3.248 . . . . 0.0 111.749 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.413 ' H ' ' C ' ' A' ' 51' ' ' ASP . 28.5 mtp180 -131.6 -25.43 2.13 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.321 0.649 . . . . 0.0 110.856 -179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.3 tp -74.73 -35.94 62.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.38 -28.24 64.17 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.47 -46.01 88.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.14 0.576 . . . . 0.0 110.144 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -80.15 -27.01 39.12 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -65.31 -43.88 89.67 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 118.101 0.41 . . . . 0.0 111.179 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.9 mmm -74.4 -32.76 62.81 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.363 -178.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.6 -36.49 78.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.264 -0.273 . . . . 0.0 110.486 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.89 -26.17 66.75 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.782 0.433 . . . . 0.0 110.133 177.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.42 -39.89 69.18 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -74.19 -34.52 37.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.075 0 CA-C-N 117.794 0.797 . . . . 0.0 110.238 177.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -66.25 -33.02 74.8 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.438 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.41 -33.03 69.09 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 122.146 -0.347 . . . . 0.0 110.454 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -70.83 -25.92 63.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.5 -34.11 47.65 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.193 0.197 . . . . 0.0 110.717 177.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -71.94 -24.32 61.6 Favored 'General case' 0 C--N 1.34 0.178 0 O-C-N 122.14 -0.35 . . . . 0.0 110.336 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.22 0.58 18.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.194 0.598 . . . . 0.0 111.584 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -133.55 -1.03 3.16 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.092 0.557 . . . . 0.0 111.457 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.07 -4.72 83.16 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 122.145 -0.347 . . . . 0.0 112.957 177.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -74.07 -6.3 46.71 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -175.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.37 22.99 1.17 Allowed 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -78.83 4.2 14.67 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.123 -0.361 . . . . 0.0 111.214 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 8.9 t -152.46 168.11 26.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.774 0.83 . . . . 0.0 109.411 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.5 t -156.02 169.94 23.31 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 110.844 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -158.55 167.62 29.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.392 1.077 . . . . 0.0 108.821 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -69.55 170.07 11.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.276 0.56 . . . . 0.0 110.562 173.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -141.78 23.5 2.09 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.65 0.78 . . . . 0.0 108.967 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.73 -174.16 4.62 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.572 1.149 . . . . 0.0 109.577 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.73 11.57 5.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.068 0.547 . . . . 0.0 110.982 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.25 12.37 0.05 OUTLIER Glycine 0 CA--C 1.53 0.995 0 CA-C-O 119.193 -0.782 . . . . 0.0 113.122 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.2 p -138.4 -15.78 1.23 Allowed 'General case' 0 C--N 1.34 0.165 0 CA-C-N 118.373 1.087 . . . . 0.0 113.051 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -137.45 -30.84 0.83 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.12 -29.41 70.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 172.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.27 -35.65 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 122.521 0.329 . . . . 0.0 110.179 177.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.27 0.8 54.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.747 0.819 . . . . 0.0 112.319 -174.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.7 ppt_? -129.51 -18.84 3.49 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.201 0.455 . . . . 0.0 111.966 176.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.47 -14.54 61.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.047 0.385 . . . . 0.0 111.182 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -130.41 5.28 4.77 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' A' ' 93' ' ' ARG . 60.7 mt -138.68 18.8 2.69 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.172 0.589 . . . . 0.0 112.272 -177.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.29 4.87 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.406 ' H ' ' C ' ' A' ' 91' ' ' LEU . 96.7 mtt180 -130.1 8.31 5.16 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.801 0.728 . . . . 0.0 111.845 -178.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 60.0 tpp -63.62 150.94 43.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 85.4 m -64.12 139.96 97.79 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -52.73 -3.64 0.12 Allowed 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 124.739 3.626 . . . . 0.0 115.937 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -135.11 -24.98 1.4 Allowed 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.317 0.962 . . . . 0.0 112.285 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 90.4 p -69.38 -21.96 63.75 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.061 0.846 . . . . 0.0 109.432 174.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -68.09 -36.83 80.44 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -74.12 -36.14 64.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.34 73.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.736 -0.173 . . . . 0.0 110.81 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 46.8 tp -64.51 -46.91 80.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.458 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 6.2 mp -72.87 -11.35 60.56 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.239 -0.288 . . . . 0.0 111.178 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.0 tp -97.62 -7.37 31.22 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 p -140.59 0.67 1.66 Allowed 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.63 0.96 6.82 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.719 0.69 . . . . 0.0 111.575 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 5.7 ptp -156.29 21.84 0.36 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 177.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -146.27 -23.65 0.44 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.941 0.337 . . . . 0.0 111.798 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.03 8.55 83.21 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 118.797 -1.002 . . . . 0.0 114.728 170.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.21 145.95 49.4 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.336 1.568 . . . . 0.0 110.439 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 52.1 m -71.16 152.6 94.6 Favored Pre-proline 0 N--CA 1.455 -0.225 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.76 -27.16 32.94 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.621 2.881 . . . . 0.0 113.945 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -79.37 -39.07 33.47 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 118.061 0.392 . . . . 0.0 111.288 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -78.32 -31.22 48.68 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.27 -26.0 64.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.386 0.274 . . . . 0.0 111.063 176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.56 -33.33 41.89 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 122.386 0.274 . . . . 0.0 110.595 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -70.29 -27.17 64.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.63 0.372 . . . . 0.0 110.764 177.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 19.7 tp -76.68 -8.44 57.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 23.0 pt -136.08 13.17 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.23 0.468 . . . . 0.0 111.609 178.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.93 55.93 7.21 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 22.4 m -136.32 179.89 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 C-N-CA 123.114 0.565 . . . . 0.0 110.313 175.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -82.63 159.76 22.61 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 176.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.5 m -57.53 -40.22 78.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 122.007 -0.433 . . . . 0.0 110.89 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -72.51 -20.81 61.29 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.655 0.382 . . . . 0.0 111.849 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -72.53 -36.7 68.36 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.635 -0.666 . . . . 0.0 109.97 176.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.24 -38.45 82.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.19 -32.86 73.55 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.56 0.164 . . . . 0.0 110.726 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.4 m -78.45 -39.37 38.79 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.43 -0.169 . . . . 0.0 110.751 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -65.34 -32.38 74.0 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 119.333 -0.365 . . . . 0.0 111.6 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.3 m -82.8 -29.17 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 CA-C-N 118.586 0.63 . . . . 0.0 110.912 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 50.9 m -67.42 -38.36 84.47 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -78.5 -27.17 46.08 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.347 -0.221 . . . . 0.0 110.658 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.37 67.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 117.833 0.288 . . . . 0.0 110.769 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.52 -22.37 57.16 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.193 -0.317 . . . . 0.0 111.232 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.66 -38.11 67.74 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.71 -26.24 61.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.351 -0.218 . . . . 0.0 110.489 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 15.3 mm -74.2 -51.18 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.14 -23.06 66.41 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -84.13 -10.74 57.54 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.521 ' C ' ' H ' ' A' ' 142' ' ' ARG . 16.5 pt20 -153.67 -54.44 0.11 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -177.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 18.9 p 46.86 -3.91 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.872 1.669 . . . . 0.0 114.982 -166.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.521 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.0 OUTLIER -78.01 166.13 23.2 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.306 0.957 . . . . 0.0 110.305 179.503 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . 0.428 ' C ' ' H ' ' A' ' 145' ' ' GLU . . . -68.37 165.31 18.98 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.04 177.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.17 23.79 0.18 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.545 0.738 . . . . 0.0 110.709 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.428 ' H ' ' C ' ' A' ' 143' ' ' ALA . 27.8 tt0 -135.37 21.26 3.4 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.881 0.873 . . . . 0.0 109.495 -177.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.466 ' CD2' ' H ' ' A' ' 147' ' ' VAL . 0.6 OUTLIER -142.74 170.18 16.19 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.623 0.769 . . . . 0.0 109.817 -179.756 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.466 ' H ' ' CD2' ' A' ' 146' ' ' LEU . 4.1 t 44.55 52.23 9.53 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 124.24 1.016 . . . . 0.0 111.57 -176.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.32 -0.67 10.34 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.582 2.855 . . . . 0.0 112.382 -176.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -150.76 160.18 44.03 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.974 0.51 . . . . 0.0 109.99 -177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -156.3 14.46 0.38 Allowed Glycine 0 CA--C 1.527 0.837 0 N-CA-C 111.536 -0.626 . . . . 0.0 111.536 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 37.8 m -65.98 177.73 1.28 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.039 0.935 . . . . 0.0 111.465 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -134.13 19.0 3.74 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.449 0.7 . . . . 0.0 110.631 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 58.8 m80 54.64 17.44 1.68 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.471 1.108 . . . . 0.0 112.794 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 51.6 p-80 -67.84 -4.52 12.95 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.522 0.729 . . . . 0.0 111.559 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -70.99 -2.36 15.08 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.887 0.875 . . . . 0.0 111.85 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -149.01 162.23 40.33 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.484 0.714 . . . . 0.0 109.635 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 67.9 m80 . . . . . 0 C--O 1.251 1.181 0 CA-C-O 117.313 -1.327 . . . . 0.0 110.511 -177.586 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 20.5 tp -146.89 9.08 0.99 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 122.397 0.279 . . . . 0.0 110.902 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -140.32 6.06 2.1 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.794 -0.566 . . . . 0.0 112.085 -176.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 73.9 mt -144.59 152.31 52.62 Favored Pre-proline 0 CA--C 1.53 0.211 0 C-N-CA 123.739 0.816 . . . . 0.0 109.687 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -75.68 -0.3 10.02 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.228 3.285 . . . . 0.0 113.335 -177.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.62 24.35 76.31 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 121.603 -0.686 . . . . 0.0 112.118 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -138.37 8.48 2.66 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.064 0.546 . . . . 0.0 110.995 -178.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -143.79 12.97 1.69 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.316 1.047 . . . . 0.0 110.421 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -65.78 -14.69 61.86 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.226 1.01 . . . . 0.0 113.329 -177.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 75.7 tttt 49.79 36.89 12.02 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.203 1.001 . . . . 0.0 112.777 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -132.45 27.35 4.41 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 124.32 1.048 . . . . 0.0 109.512 177.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -140.23 -174.96 4.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.093 0.957 . . . . 0.0 110.109 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 11.0 t -134.25 16.47 3.76 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.723 0.409 . . . . 0.0 110.909 -176.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 24.8 t -148.64 167.76 24.62 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.316 0.646 . . . . 0.0 109.598 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.57 171.56 19.24 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.058 0.543 . . . . 0.0 110.778 -177.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 38.2 mtmm -141.33 168.4 19.88 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 123.758 0.823 . . . . 0.0 109.829 178.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 49.8 m -148.86 161.04 34.05 Favored Pre-proline 0 CA--C 1.53 0.211 0 C-N-CA 122.935 0.494 . . . . 0.0 110.489 -178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.27 174.38 0.24 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 124.698 3.599 . . . . 0.0 113.649 175.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.72 174.19 1.1 Allowed 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.851 0.86 . . . . 0.0 111.663 176.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -150.29 157.83 43.5 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.684 176.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 27.8 m -146.96 -172.89 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 123.879 0.871 . . . . 0.0 109.864 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.92 4.62 4.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.363 0.665 . . . . 0.0 111.562 -178.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 31.4 t -155.51 168.17 28.0 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.359 0.664 . . . . 0.0 109.396 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -143.94 167.13 23.06 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 123.502 0.721 . . . . 0.0 109.986 -177.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -67.97 -18.78 64.84 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.122 0.569 . . . . 0.0 112.0 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 51.5 tpt85 58.54 -41.72 0.06 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 127.891 2.477 . . . . 0.0 114.661 -176.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -164.12 -9.95 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.826 0.85 . . . . 0.0 111.479 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -62.26 -26.8 68.59 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 118.034 0.379 . . . . 0.0 111.656 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.57 -36.18 58.89 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.79 -24.47 58.66 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.968 0.384 . . . . 0.0 110.813 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.86 -45.48 70.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 84.2 mt -76.49 -36.46 57.82 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.598 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -65.5 -42.46 92.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -64.01 -42.05 97.26 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.355 0.525 . . . . 0.0 111.028 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.13 -29.39 70.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.561 0.219 . . . . 0.0 111.463 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -102.86 -12.49 17.51 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.125 -0.359 . . . . 0.0 111.331 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . 0.476 HE21 ' CG ' ' B' ' 41' ' ' GLU . 62.9 tp60 -69.16 -34.11 74.46 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 175.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -73.89 -24.71 59.75 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 121.068 -0.253 . . . . 0.0 110.937 176.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 26.6 m -73.14 -12.14 60.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 27.2 pt -123.25 18.02 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.097 0 O-C-N 121.814 -0.554 . . . . 0.0 112.464 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . 0.476 ' CG ' HE21 ' B' ' 37' ' ' GLN . 74.0 mm-40 -132.85 25.29 4.32 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -177.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.42 -15.77 0.84 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -166.41 158.8 14.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.179 0.9 . . . . 0.0 111.451 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.84 150.49 59.89 Favored Pre-proline 0 C--O 1.233 0.185 0 C-N-CA 124.318 1.047 . . . . 0.0 108.536 171.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . 0.46 ' C ' ' H ' ' B' ' 47' ' ' GLU . 72.1 Cg_endo -73.83 -35.78 4.14 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.016 2.478 . . . . 0.0 112.588 -177.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.2 t70 49.28 -10.49 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 127.481 2.312 . . . . 0.0 116.231 -177.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.46 ' H ' ' C ' ' B' ' 45' ' ' PRO . 15.7 pt-20 -69.4 -16.97 63.61 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.921 -1.112 . . . . 0.0 111.831 -177.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 42.0 mtm -74.09 -12.22 60.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.95 0.5 . . . . 0.0 111.297 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 87.9 mt -108.37 -17.28 14.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -68.19 -21.08 64.89 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.427 ' O ' ' HE2' ' B' ' 54' ' ' LYS . 4.2 pp -98.68 -6.82 28.92 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 122.881 0.472 . . . . 0.0 112.174 177.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.502 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.9 mt -89.9 -15.19 32.66 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.918 0.781 . . . . 0.0 109.906 166.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.59 22.68 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.532 1.133 . . . . 0.0 111.296 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.502 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.5 pttt -135.16 -4.11 2.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.78 0.832 . . . . 0.0 112.087 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -155.96 -5.83 0.12 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.39 2.46 0.64 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.958 0.799 . . . . 0.0 112.853 -176.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 4.2 mt -152.3 159.56 43.47 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.928 0.491 . . . . 0.0 110.58 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -148.86 162.56 39.6 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.242 1.017 . . . . 0.0 108.823 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 26.8 tp -151.88 -6.76 0.23 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 13.0 p -153.61 138.44 11.38 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 118.736 0.698 . . . . 0.0 109.833 -178.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.65 175.02 11.28 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.434 2.756 . . . . 0.0 110.997 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.208 0 C-N-CA 123.092 0.557 . . . . 0.0 111.033 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptm . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 m -142.35 21.77 2.04 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.054 0.542 . . . . 0.0 111.524 -174.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.1 tp -52.63 -30.81 33.51 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.485 0.714 . . . . 0.0 112.597 -177.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.97 -20.79 78.06 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.427 -176.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -79.07 -1.0 33.68 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 117.42 0.61 . . . . 0.0 111.684 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -134.1 -13.88 2.4 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.452 0.301 . . . . 0.0 111.594 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 tp -80.23 -42.08 23.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.197 -0.314 . . . . 0.0 110.166 173.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.42 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.37 -45.47 99.86 Favored Pre-proline 0 CA--C 1.531 0.219 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -175.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 74.3 Cg_endo -70.64 -4.16 14.05 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.373 2.048 . . . . 0.0 112.177 -178.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.31 10.17 4.84 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.405 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 48.3 mt -57.26 -40.34 84.0 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.351 -0.833 . . . . 0.0 112.434 173.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.405 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 88.1 Cg_endo -77.87 -16.47 14.44 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 CA-C-N 120.842 1.337 . . . . 0.0 112.634 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -69.66 -24.98 63.69 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 118.435 0.561 . . . . 0.0 109.867 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.71 -21.65 65.3 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 175.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -92.46 -22.19 19.74 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.488 0.315 . . . . 0.0 110.386 178.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.3 ttp180 -52.69 -29.02 24.34 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 124.271 1.028 . . . . 0.0 110.773 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -138.27 -9.69 1.49 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 111.433 0.16 . . . . 0.0 111.433 177.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.96 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.89 -29.98 66.21 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.99 0.895 . . . . 0.0 110.264 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.23 -2.01 32.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.431 0.692 . . . . 0.0 111.358 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.3 mt -114.9 5.13 15.02 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.629 0.772 . . . . 0.0 111.501 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.8 p -141.6 -22.63 0.73 Allowed 'General case' 0 C--O 1.231 0.109 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.86 17.29 50.14 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.287 0.494 . . . . 0.0 112.08 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.2 t -153.45 131.97 12.16 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.62 0.71 . . . . 0.0 110.023 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.94 -20.77 64.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.872 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -70.94 -38.5 72.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.065 0.393 . . . . 0.0 110.578 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -82.19 -28.25 32.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.21 0.204 . . . . 0.0 110.745 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.6 -39.03 26.56 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.781 -0.927 . . . . 0.0 110.781 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -73.31 -30.37 63.33 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.283 0.542 . . . . 0.0 111.088 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -25.22 27.68 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 120.178 -0.609 . . . . 0.0 111.413 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -63.57 -37.91 89.13 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.076 0.853 . . . . 0.0 109.442 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.3 t -63.79 -46.65 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 117.704 0.229 . . . . 0.0 110.772 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -79.21 -32.59 44.05 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.534 -175.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.53 -25.99 63.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.13 -43.76 94.28 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.88 -41.28 62.42 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.573 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -62.46 -26.75 68.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.121 -0.362 . . . . 0.0 111.823 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.59 0.63 29.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.898 0.479 . . . . 0.0 111.363 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 72.6 mt -120.66 -13.47 8.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.227 1.011 . . . . 0.0 109.866 -177.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.6 t -58.83 -11.48 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 123.62 0.768 . . . . 0.0 111.921 175.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.75 3.0 9.52 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 123.47 0.708 . . . . 0.0 110.579 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.12 53.66 0.96 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 123.888 0.875 . . . . 0.0 110.978 -174.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.23 -10.12 27.97 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.933 2.422 . . . . 0.0 113.264 -175.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -78.96 -17.84 54.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.415 0.552 . . . . 0.0 110.654 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -78.56 -1.19 32.81 Favored 'General case' 0 C--N 1.335 -0.062 0 C-N-CA 125.025 1.33 . . . . 0.0 111.464 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -131.26 60.51 53.3 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 123.559 0.744 . . . . 0.0 109.995 -176.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.25 171.52 15.88 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 124.057 3.172 . . . . 0.0 111.409 -176.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -115.51 12.84 16.29 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.167 0.987 . . . . 0.0 109.658 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -72.27 10.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.71 1.204 . . . . 0.0 111.507 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.95 174.87 12.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 124.386 1.074 . . . . 0.0 109.504 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -55.4 148.05 34.78 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -68.34 10.62 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 123.865 3.043 . . . . 0.0 112.139 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -129.08 -25.06 2.8 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.012 0.525 . . . . 0.0 111.18 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.82 -32.98 68.13 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.522 0.601 . . . . 0.0 110.189 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.38 -34.14 57.91 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 177.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.39 -43.65 96.98 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.961 0.381 . . . . 0.0 109.992 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.14 -32.23 44.32 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -62.46 -41.12 98.53 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.179 -0.326 . . . . 0.0 110.959 -178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -80.93 -29.94 35.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.665 -177.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -66.86 -35.89 81.08 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -67.38 -27.68 67.3 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.114 0.566 . . . . 0.0 109.807 176.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.07 -39.86 92.96 Favored Glycine 0 CA--C 1.528 0.871 0 CA-C-O 119.796 -0.447 . . . . 0.0 112.055 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 48.6 mm -72.9 -37.97 55.55 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.071 0 CA-C-N 118.132 0.966 . . . . 0.0 110.264 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -31.79 70.1 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -31.4 61.56 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 121.309 -0.869 . . . . 0.0 110.503 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.8 t -75.52 -28.04 58.96 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.587 0.355 . . . . 0.0 110.988 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.92 70.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 122.158 -0.339 . . . . 0.0 110.124 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -72.57 -16.03 61.75 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.382 -0.199 . . . . 0.0 110.954 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.27 4.36 39.28 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.888 0.475 . . . . 0.0 110.968 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -133.29 -4.33 3.03 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.41 0.684 . . . . 0.0 111.128 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.39 -4.98 62.45 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.591 -0.561 . . . . 0.0 113.186 175.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -67.17 135.07 52.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.891 0.845 . . . . 0.0 110.31 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -165.69 173.57 10.63 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.451 0.701 . . . . 0.0 110.58 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -147.37 168.52 21.61 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 124.231 1.012 . . . . 0.0 109.085 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.4 t -64.9 -21.37 66.8 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.795 0.438 . . . . 0.0 111.363 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 92.1 p 44.72 24.16 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.767 1.627 . . . . 0.0 114.226 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -56.01 -60.41 3.52 Favored 'General case' 0 CA--C 1.527 0.065 0 C-N-CA 123.139 0.576 . . . . 0.0 111.572 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 81.0 p -178.79 177.53 0.86 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 123.558 0.743 . . . . 0.0 110.635 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -138.18 17.74 2.79 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.365 1.066 . . . . 0.0 108.797 175.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.62 -173.59 4.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.188 0.995 . . . . 0.0 110.219 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -139.81 10.8 2.44 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.787 0.435 . . . . 0.0 112.014 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -167.62 9.28 0.05 OUTLIER Glycine 0 CA--C 1.529 0.958 0 CA-C-O 119.359 -0.689 . . . . 0.0 113.721 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.5 t -147.4 7.52 0.88 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.471 1.135 . . . . 0.0 111.946 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -152.43 -33.07 0.13 Allowed 'General case' 0 CA--C 1.528 0.117 0 O-C-N 121.935 -0.478 . . . . 0.0 109.79 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.12 -23.71 63.07 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.9 p -66.84 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.138 0 C-N-CA 122.664 0.386 . . . . 0.0 110.03 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.7 -17.12 52.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 122.732 0.413 . . . . 0.0 111.137 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -88.1 -51.34 5.85 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.26 -1.67 4.86 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -171.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -130.22 6.22 4.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.015 0.526 . . . . 0.0 111.996 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 84.9 mt -144.5 19.27 1.7 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.791 0.836 . . . . 0.0 110.782 -178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.51 5.95 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -130.39 0.97 4.57 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.337 0.971 . . . . 0.0 112.255 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 ttm -68.17 152.15 45.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.2 m -59.25 137.88 88.5 Favored Pre-proline 0 CA--C 1.532 0.251 0 C-N-CA 123.178 0.591 . . . . 0.0 109.667 176.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.36 5.42 1.55 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.933 3.089 . . . . 0.0 114.01 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -130.95 -32.68 1.62 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.632 0.651 . . . . 0.0 110.298 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.6 m -62.64 -19.38 63.74 Favored 'General case' 0 CA--C 1.527 0.069 0 O-C-N 121.852 -0.53 . . . . 0.0 110.39 173.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.83 -33.84 76.78 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.071 0.548 . . . . 0.0 110.517 175.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -77.59 -30.37 52.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.53 -32.35 73.07 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.07 -0.394 . . . . 0.0 110.289 175.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 38.2 tp -66.32 -44.13 84.25 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.763 0.425 . . . . 0.0 110.438 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.87 -10.01 59.08 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.456 0.571 . . . . 0.0 111.677 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.8 mt -96.58 -4.71 40.73 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 67.7 p -137.19 6.05 2.8 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -177.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -139.54 10.55 2.49 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 177.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.5 mtm -140.07 -10.11 1.14 Allowed 'General case' 0 C--N 1.341 0.216 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -148.1 -8.25 0.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.225 0.92 . . . . 0.0 112.634 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 70.22 20.0 76.26 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.296 -0.724 . . . . 0.0 113.848 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -58.0 150.6 20.38 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.64 1.22 . . . . 0.0 109.884 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.2 p -70.24 160.79 79.61 Favored Pre-proline 0 C--O 1.233 0.207 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.82 -16.07 45.25 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 121.933 1.755 . . . . 0.0 110.521 176.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -79.28 -37.43 37.85 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 117.94 0.336 . . . . 0.0 110.823 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -76.95 -36.09 56.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 117.938 0.335 . . . . 0.0 110.129 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.0 -27.53 64.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.591 -0.243 . . . . 0.0 111.227 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.97 -36.44 64.58 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.727 0.298 . . . . 0.0 110.575 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -68.52 -31.11 70.13 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.861 0.465 . . . . 0.0 110.688 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.86 -7.45 57.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 8.6 pt -135.72 13.92 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.739 0.699 . . . . 0.0 111.992 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 56.8 53.61 8.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 29.1 m -137.16 179.13 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 122.936 0.494 . . . . 0.0 110.399 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.31 161.32 20.48 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.758 0.423 . . . . 0.0 110.178 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.7 m -60.74 -36.55 79.19 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.057 -0.402 . . . . 0.0 110.919 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -23.95 61.48 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.371 0.268 . . . . 0.0 110.946 -178.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.39 -36.55 68.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.789 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.7 t -64.81 -36.5 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -62.87 -34.57 77.66 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.651 0.263 . . . . 0.0 110.594 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.1 m -77.03 -37.52 54.74 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 177.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mp -66.46 -32.79 74.38 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.074 -0.489 . . . . 0.0 111.694 -178.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.62 -26.59 12.52 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.873 0.761 . . . . 0.0 110.811 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 99.0 m -68.89 -37.72 79.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -76.34 -27.62 56.56 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 122.273 -0.267 . . . . 0.0 110.319 176.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.4 -48.07 62.22 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.852 0.296 . . . . 0.0 110.471 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.87 -22.74 65.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 117.855 0.298 . . . . 0.0 111.129 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.44 -38.62 59.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 173.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -69.46 -30.11 67.94 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 119.757 -0.163 . . . . 0.0 110.571 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.9 mm -64.71 -49.41 80.35 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.69 -20.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -77.76 -20.88 52.61 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -176.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -151.69 -10.63 0.21 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.4 p -68.96 -19.03 64.16 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 119.951 1.25 . . . . 0.0 112.164 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.31 157.46 31.62 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 122.718 0.407 . . . . 0.0 111.093 177.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -150.26 4.88 0.54 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 5.3 mp -142.0 163.62 32.39 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.017 0.527 . . . . 0.0 109.85 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -142.45 1.7 1.39 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.599 0.759 . . . . 0.0 110.572 177.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.593 ' CD1' ' H ' ' A' ' 147' ' ' VAL . 0.1 OUTLIER -155.54 178.25 10.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.248 1.019 . . . . 0.0 108.477 -179.227 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.593 ' H ' ' CD1' ' A' ' 146' ' ' LEU . 52.5 t -141.2 125.3 10.31 Favored Pre-proline 0 N--CA 1.455 -0.218 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -75.69 172.83 15.56 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.699 2.933 . . . . 0.0 111.501 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -143.77 166.93 23.51 Favored 'General case' 0 C--O 1.23 0.073 0 C-N-CA 123.557 0.743 . . . . 0.0 110.014 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 176.89 -179.14 47.99 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 84.9 p -153.88 172.8 16.82 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 122.613 0.365 . . . . 0.0 110.751 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 69.3 m80 -146.33 172.62 13.21 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.738 0.815 . . . . 0.0 109.948 -178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -146.48 9.56 1.07 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.577 0.351 . . . . 0.0 111.912 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 19.3 p80 -153.69 169.45 23.26 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.867 0.467 . . . . 0.0 110.641 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 52.9 p-80 -153.7 -1.52 0.21 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.077 0.551 . . . . 0.0 111.603 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 38.1 t-80 -157.45 166.15 33.76 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.114 0.566 . . . . 0.0 109.879 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 76.6 t60 . . . . . 0 C--O 1.252 1.226 0 CA-C-O 117.177 -1.392 . . . . 0.0 110.393 179.685 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 110.475 -0.194 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -148.81 5.03 0.67 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.964 0.505 . . . . 0.0 111.975 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -153.78 163.59 39.76 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 89.9 mt -144.81 160.67 46.26 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 123.853 0.861 . . . . 0.0 109.802 -177.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -52.01 162.36 1.94 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 124.148 3.232 . . . . 0.0 113.09 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.77 2.14 0.03 OUTLIER Glycine 0 CA--C 1.528 0.893 0 CA-C-O 119.719 -0.49 . . . . 0.0 112.758 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -152.54 150.93 30.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 117.921 0.861 . . . . 0.0 109.547 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -144.25 8.79 1.41 Allowed 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.441 0.697 . . . . 0.0 111.361 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -75.16 -5.84 46.47 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.735 0.414 . . . . 0.0 110.852 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -67.23 -3.36 7.62 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.627 0.771 . . . . 0.0 112.105 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -143.9 2.46 1.19 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.189 0.595 . . . . 0.0 112.026 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . 48.67 -169.2 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.048 0.939 . . . . 0.0 112.855 -175.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 49.7 m -139.29 5.88 2.3 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.028 0.531 . . . . 0.0 111.383 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 25.0 m 50.49 16.83 0.31 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.03 1.332 . . . . 0.0 114.141 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -142.55 0.9 1.32 Allowed 'General case' 0 C--N 1.34 0.183 0 C-N-CA 123.215 0.606 . . . . 0.0 111.646 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -157.7 156.52 31.85 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.246 0.618 . . . . 0.0 109.435 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 83.1 p -153.7 156.8 32.5 Favored Pre-proline 0 CA--C 1.53 0.182 0 C-N-CA 122.873 0.469 . . . . 0.0 109.86 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -78.09 4.94 5.75 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 124.239 3.293 . . . . 0.0 112.269 178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.31 148.44 32.18 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.785 0.434 . . . . 0.0 111.969 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -162.65 157.07 21.39 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 174.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 19.9 m -144.8 161.99 13.89 Favored 'Isoleucine or valine' 0 C--O 1.23 0.078 0 C-N-CA 123.111 0.565 . . . . 0.0 110.411 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -157.22 18.7 0.29 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.667 0.787 . . . . 0.0 110.929 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.0 p -51.25 148.28 4.86 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.439 0.696 . . . . 0.0 112.592 -175.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 ptpp? -156.1 14.84 0.33 Allowed 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.307 1.043 . . . . 0.0 110.515 -178.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -75.18 18.2 0.21 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 125.024 1.33 . . . . 0.0 112.419 -177.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.3 ptp180 -143.79 171.38 14.29 Favored 'General case' 0 N--CA 1.458 -0.059 0 C-N-CA 123.103 0.561 . . . . 0.0 111.826 -172.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -142.27 22.26 2.04 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 123.925 0.89 . . . . 0.0 111.067 -175.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.2 tpt -52.93 -26.97 16.71 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.634 0.773 . . . . 0.0 112.349 -177.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.22 -40.54 87.7 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.24 -22.7 60.36 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.549 -0.383 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.88 -37.83 67.18 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 81.7 mt -73.97 -37.41 64.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.98 -32.45 72.86 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 119.533 -0.27 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 62.3 m -66.62 -43.86 83.62 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.221 0.464 . . . . 0.0 110.705 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -26.97 65.12 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -103.7 -16.54 15.43 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 122.111 -0.368 . . . . 0.0 111.526 -176.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tp60 -64.45 -33.67 76.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 169.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -55.15 -38.66 68.54 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.157 0.583 . . . . 0.0 110.646 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 95.6 m -67.06 -12.61 60.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.835 0.454 . . . . 0.0 112.208 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 69.6 mt -105.54 -14.89 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.048 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -75.54 19.51 0.19 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.855 0.462 . . . . 0.0 111.53 176.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -136.48 169.05 18.31 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.054 0.454 . . . . 0.0 111.055 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -56.37 165.31 1.11 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.761 1.224 . . . . 0.0 113.129 -173.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.5 m -125.92 155.61 72.79 Favored Pre-proline 0 C--O 1.232 0.169 0 C-N-CA 124.022 0.929 . . . . 0.0 109.663 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.9 179.62 6.32 Favored 'Trans proline' 0 N--CA 1.448 -1.152 0 C-N-CA 122.938 2.425 . . . . 0.0 109.898 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -146.77 0.25 0.75 Allowed 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.589 0.356 . . . . 0.0 111.071 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -67.81 -18.13 64.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -175.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.9 mpp? -70.22 -29.15 65.9 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-N 118.204 0.456 . . . . 0.0 109.8 176.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -93.31 -25.02 17.92 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.49 -20.88 66.53 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.4 pp -98.11 0.61 46.39 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.492 0.317 . . . . 0.0 111.626 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.463 ' C ' ' H ' ' B' ' 54' ' ' LYS . 23.8 mt -83.84 -21.83 31.92 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 166.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -66.12 17.28 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.1 0.96 . . . . 0.0 113.155 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.463 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.4 pttt -128.12 6.18 5.92 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.427 0.691 . . . . 0.0 111.236 177.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.2 -15.51 0.35 Allowed 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.107 0.563 . . . . 0.0 111.591 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.83 -2.46 23.73 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 117.935 0.334 . . . . 0.0 110.697 171.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 28.5 tp -151.81 169.85 21.22 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.54 1.136 . . . . 0.0 108.714 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 57.83 -176.26 0.07 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.411 1.084 . . . . 0.0 112.287 -176.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -120.8 9.07 10.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.497 0.719 . . . . 0.0 110.754 -177.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 14.0 p -150.86 138.96 12.55 Favored Pre-proline 0 CA--C 1.532 0.26 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -73.38 174.28 12.4 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.544 2.829 . . . . 0.0 111.287 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 51.3 tpt85 . . . . . 0 N--CA 1.458 -0.073 0 C-N-CA 123.416 0.687 . . . . 0.0 110.39 -179.597 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.5 tpp . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 119.819 -0.134 . . . . 0.0 110.803 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.3 t -152.18 153.38 33.72 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 122.712 0.405 . . . . 0.0 110.127 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.52 -26.68 66.45 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.335 0.654 . . . . 0.0 111.228 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.95 -23.14 78.41 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.744 -0.598 . . . . 0.0 112.046 -176.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -81.17 2.99 25.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.865 0.466 . . . . 0.0 111.004 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -131.51 -21.71 2.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.532 0.733 . . . . 0.0 111.089 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.3 tp -78.55 -38.79 39.54 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.298 -0.251 . . . . 0.0 110.926 176.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.8 -45.78 99.78 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -172.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -72.86 -3.84 14.31 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.487 2.125 . . . . 0.0 113.285 -175.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -135.71 8.7 3.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.368 0.531 . . . . 0.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.8 tp -56.38 -44.03 99.55 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 124.14 0.976 . . . . 0.0 113.107 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -81.8 -11.76 11.26 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.203 1.936 . . . . 0.0 113.373 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -64.9 -23.49 67.24 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 118.942 0.792 . . . . 0.0 111.255 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.75 -19.03 65.67 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 122.252 -0.28 . . . . 0.0 110.9 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm105 -103.03 -20.91 14.02 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.702 0.401 . . . . 0.0 111.042 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -62.84 -16.43 58.44 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.364 0.529 . . . . 0.0 111.805 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -140.32 -21.3 0.84 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.578 0.351 . . . . 0.0 111.449 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.66 -25.1 68.61 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 111.56 -0.616 . . . . 0.0 111.56 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -66.86 -12.12 58.11 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.386 0.593 . . . . 0.0 111.977 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -114.12 -6.45 13.07 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 122.962 0.505 . . . . 0.0 111.881 -174.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.5 mt -82.76 -0.36 47.34 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.04 0.382 . . . . 0.0 111.22 174.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 t -148.29 -4.13 0.47 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -175.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.16 17.04 78.54 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 121.553 -0.717 . . . . 0.0 113.034 174.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.3 t -156.1 126.23 6.56 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.143 0.971 . . . . 0.0 110.272 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -69.32 -19.04 63.88 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.715 -0.22 . . . . 0.0 110.78 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -74.29 -33.14 63.15 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -76.46 -35.11 58.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -71.36 -36.1 63.28 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -73.02 -34.67 66.5 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 117.565 0.682 . . . . 0.0 111.451 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.82 -22.93 49.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.431 178.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -67.32 -36.79 82.19 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 37.3 t -60.4 -47.01 94.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 CA-C-N 117.932 0.333 . . . . 0.0 110.58 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -77.38 -29.86 53.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.511 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.67 -27.39 61.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.604 -0.147 . . . . 0.0 110.604 176.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 59.4 m -66.93 -38.9 87.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.43 -44.1 53.34 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -176.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.3 -24.67 67.74 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 122.081 -0.387 . . . . 0.0 110.522 -178.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.38 0.16 23.48 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.378 0.671 . . . . 0.0 111.636 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.5 mt -122.7 -14.02 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 124.008 0.923 . . . . 0.0 109.879 -177.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.0 t -58.92 -15.54 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.142 0.577 . . . . 0.0 112.021 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.19 4.98 9.77 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.344 0.658 . . . . 0.0 110.884 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.18 53.88 0.91 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.144 0.578 . . . . 0.0 111.199 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -64.7 -10.83 26.26 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.291 2.66 . . . . 0.0 112.405 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.57 -15.34 61.29 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.494 0.318 . . . . 0.0 110.878 175.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -85.68 0.5 52.54 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.722 0.409 . . . . 0.0 111.664 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -129.17 63.99 69.3 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 122.799 0.44 . . . . 0.0 110.296 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.24 168.36 21.1 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 124.214 3.276 . . . . 0.0 111.918 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.53 12.17 10.73 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.054 0.942 . . . . 0.0 109.795 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -72.68 10.68 0.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.196 0.998 . . . . 0.0 111.52 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.4 m -135.86 174.69 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 C-N-CA 124.2 1.0 . . . . 0.0 109.216 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.31 146.23 32.92 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.104 0.161 . . . . 0.0 110.824 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.07 11.78 0.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 124.242 3.294 . . . . 0.0 112.37 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -128.75 -16.6 4.18 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.028 0.531 . . . . 0.0 110.428 174.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.63 -35.87 38.75 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 118.136 0.426 . . . . 0.0 109.888 -178.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.61 -32.63 45.68 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.2 -46.6 89.17 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.059 0.543 . . . . 0.0 110.214 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -74.05 -33.85 63.85 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.721 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.6 tpm_? -63.77 -43.15 97.23 Favored 'General case' 0 C--N 1.337 0.05 0 CA-C-N 118.728 0.695 . . . . 0.0 111.116 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 88.8 mmm -71.0 -34.38 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.576 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -68.82 -37.07 78.94 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.325 -0.234 . . . . 0.0 110.748 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -67.94 -20.17 65.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.509 0.323 . . . . 0.0 110.377 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.1 -40.41 50.81 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.4 mm -73.61 -34.34 41.47 Favored 'Isoleucine or valine' 0 C--N 1.338 0.089 0 CA-C-N 117.552 0.676 . . . . 0.0 109.852 176.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.0 t90 -65.54 -36.36 83.57 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.419 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.06 69.53 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.082 -0.386 . . . . 0.0 110.563 177.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.1 t -75.07 -28.93 60.53 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.317 0.247 . . . . 0.0 110.743 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.02 64.77 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.334 -0.229 . . . . 0.0 111.049 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -86.64 -12.84 47.32 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.465 0.306 . . . . 0.0 110.758 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.4 4.56 34.84 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.191 0.596 . . . . 0.0 111.131 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -137.7 0.82 2.27 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.107 0.563 . . . . 0.0 111.033 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.34 13.13 83.12 Favored Glycine 0 CA--C 1.528 0.885 0 CA-C-O 119.676 -0.514 . . . . 0.0 113.12 176.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -64.25 -18.38 64.5 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 117.949 0.875 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.42 155.15 31.61 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.119 0.968 . . . . 0.0 109.095 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -146.89 -10.68 0.45 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.8 t -164.52 174.52 10.82 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.767 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.7 p -155.82 167.3 30.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.736 0.814 . . . . 0.0 110.087 177.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -152.29 -50.34 0.11 Allowed 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 122.452 -0.155 . . . . 0.0 111.279 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -169.31 160.49 9.49 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.506 0.322 . . . . 0.0 110.985 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -160.24 23.73 0.16 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.082 0.953 . . . . 0.0 110.037 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.39 174.75 10.47 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.163 0.506 . . . . 0.0 111.227 -176.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -9.38 17.32 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.86 -11.79 0.14 Allowed Glycine 0 CA--C 1.527 0.828 0 CA-C-O 119.566 -0.575 . . . . 0.0 113.121 178.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.5 p -66.65 -3.54 6.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.295 1.047 . . . . 0.0 113.066 -176.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -129.19 -29.76 2.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.92 68.27 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -65.89 -29.86 48.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.444 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -0.06 53.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.395 0.678 . . . . 0.0 111.809 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -130.48 -16.59 3.43 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.865 0.302 . . . . 0.0 111.229 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.45 -1.42 15.67 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.855 0.462 . . . . 0.0 110.447 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -130.49 -12.87 3.88 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.352 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 73.8 mt -144.82 34.21 1.13 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.338 0.655 . . . . 0.0 111.247 -171.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.7 2.88 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -130.52 -5.92 4.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.532 1.06 . . . . 0.0 112.3 -177.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.8 ttm -67.35 146.05 54.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.325 0.511 . . . . 0.0 110.31 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 93.9 m -65.65 137.25 96.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.83 -20.75 39.05 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.578 2.185 . . . . 0.0 112.956 -174.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -78.61 -34.73 46.43 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.3 m -65.36 -23.41 66.98 Favored 'General case' 0 N--CA 1.457 -0.105 0 O-C-N 122.043 -0.411 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 62.6 mtm180 -67.88 -26.0 65.79 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.063 0.392 . . . . 0.0 110.556 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -77.72 -39.0 45.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.57 -33.25 74.65 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 122.082 -0.386 . . . . 0.0 110.202 177.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -54.43 46.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.974 0.509 . . . . 0.0 109.721 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.481 ' HA ' ' HE2' ' A' ' 107' ' ' MET . 4.4 pp -71.53 -15.44 62.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.1 mt -84.24 -9.3 58.63 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.882 0.31 . . . . 0.0 111.827 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.4 p -135.44 12.47 3.5 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -132.48 -0.65 3.57 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.481 ' HE2' ' HA ' ' A' ' 103' ' ' LEU . 33.3 mtm -145.9 -11.79 0.5 Allowed 'General case' 0 C--N 1.34 0.173 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -138.09 -2.91 1.82 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.23 0.923 . . . . 0.0 112.266 -175.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 55.58 26.47 45.81 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.167 -0.796 . . . . 0.0 114.315 173.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -56.68 151.62 13.63 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.493 1.146 . . . . 0.0 110.633 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.4 t -64.55 149.38 95.46 Favored Pre-proline 0 N--CA 1.453 -0.285 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 171.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -64.44 -16.54 55.67 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.938 1.759 . . . . 0.0 110.648 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -76.18 -39.85 53.81 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 117.767 0.258 . . . . 0.0 110.344 176.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -74.63 -35.26 62.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 122.119 -0.363 . . . . 0.0 110.312 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.04 -28.1 67.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.22 -0.3 . . . . 0.0 111.053 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.32 -27.69 42.1 Favored 'General case' 0 CA--C 1.526 0.05 0 C-N-CA 122.541 0.336 . . . . 0.0 110.403 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -75.13 -22.62 58.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.258 1.023 . . . . 0.0 111.037 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 69.8 mt -88.49 -7.88 55.8 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 7.5 pt -135.55 15.23 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.726 0.694 . . . . 0.0 111.351 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 46.13 62.17 2.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.952 1.701 . . . . 0.0 114.691 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 31.2 m -136.9 -179.78 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 C-N-CA 124.077 0.951 . . . . 0.0 109.392 174.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -81.41 159.93 24.19 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -60.6 -36.87 79.62 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 122.152 -0.342 . . . . 0.0 110.799 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.0 t -72.91 -24.64 60.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.134 0.174 . . . . 0.0 110.932 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.95 -34.14 68.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.085 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.9 t -65.72 -38.04 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.109 0 CA-C-N 118.211 0.46 . . . . 0.0 109.769 177.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.66 -35.78 77.07 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.7 m -76.29 -37.98 56.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.342 -0.224 . . . . 0.0 110.743 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mp -65.17 -36.19 83.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.666 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.44 -28.5 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-N 118.515 0.598 . . . . 0.0 110.974 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.7 m -68.67 -38.79 80.65 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -78.17 -26.17 47.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 122.356 -0.215 . . . . 0.0 110.638 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.21 -50.74 37.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.57 -22.51 65.38 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 117.73 0.241 . . . . 0.0 111.1 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.29 -34.77 76.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -81.59 -18.62 44.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.261 176.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 25.9 mm -68.91 -53.13 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 173.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.65 -16.83 62.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -64.91 -21.44 66.82 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.483 ' C ' ' H ' ' A' ' 142' ' ' ARG . 19.2 pt20 -155.57 -43.32 0.08 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -171.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 44.6 p 46.3 -1.97 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -169.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.483 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.1 OUTLIER -156.51 165.36 36.52 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.843 1.202 . . . . 0.0 110.413 174.36 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.08 23.51 1.19 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.076 0.551 . . . . 0.0 110.51 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -138.59 176.84 8.35 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.616 0.766 . . . . 0.0 110.174 -179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 56.78 22.61 7.12 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.464 0.706 . . . . 0.0 110.767 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.56 -172.44 0.35 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.456 1.102 . . . . 0.0 111.504 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 28.9 m -128.26 153.63 78.87 Favored Pre-proline 0 CA--C 1.53 0.21 0 C-N-CA 123.549 0.74 . . . . 0.0 110.029 -177.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.24 176.01 9.16 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 124.434 3.422 . . . . 0.0 112.149 -178.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 45.43 -178.51 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 127.731 2.412 . . . . 0.0 115.208 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 175.02 23.8 0.03 OUTLIER Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.321 -0.711 . . . . 0.0 111.321 -177.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 70.0 p -59.35 164.66 3.16 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.486 0.715 . . . . 0.0 112.261 -177.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 28.9 p80 -148.84 16.23 0.97 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.718 0.807 . . . . 0.0 110.796 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 50.7 p-80 -143.95 -179.93 6.79 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.643 0.777 . . . . 0.0 110.4 -175.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -146.07 -179.5 6.76 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.079 0.552 . . . . 0.0 110.859 -177.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -146.43 168.29 21.52 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.234 0.614 . . . . 0.0 109.513 -179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -146.16 14.67 1.31 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -175.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 35.7 m80 . . . . . 0 C--O 1.253 1.278 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.008 176.71 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 110.469 -0.197 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -144.89 4.29 1.11 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 122.596 0.358 . . . . 0.0 111.744 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -75.45 -2.81 30.51 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.862 0.465 . . . . 0.0 110.993 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -151.91 156.65 34.3 Favored Pre-proline 0 N--CA 1.448 -0.543 0 C-N-CA 124.079 0.951 . . . . 0.0 109.049 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -73.96 -10.96 23.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.118 2.546 . . . . 0.0 112.64 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 124.99 -4.68 8.4 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-O 119.778 -0.456 . . . . 0.0 112.426 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -71.22 5.86 1.97 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 117.568 0.684 . . . . 0.0 112.827 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 77.0 tttt 51.45 28.78 4.72 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.996 0.918 . . . . 0.0 111.46 -177.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -149.99 173.25 14.03 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.533 0.733 . . . . 0.0 109.658 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -138.65 -173.68 3.62 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.09 0.956 . . . . 0.0 109.799 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 53.1 tttm 56.77 29.06 15.28 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.708 0.803 . . . . 0.0 111.073 -177.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.94 12.61 2.04 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.765 0.826 . . . . 0.0 110.66 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 32.2 t -153.0 173.82 14.93 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.876 0.87 . . . . 0.0 109.327 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 90.5 p -145.07 16.6 1.55 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.64 0.776 . . . . 0.0 110.724 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 57.09 18.48 4.09 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.608 1.163 . . . . 0.0 111.801 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -138.43 7.47 2.59 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.612 1.165 . . . . 0.0 110.376 177.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 65.6 p -150.78 53.38 1.19 Allowed Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.921 0.888 . . . . 0.0 110.41 178.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -70.37 177.31 6.14 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 123.738 2.959 . . . . 0.0 111.448 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.42 172.74 1.07 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.633 0.773 . . . . 0.0 112.143 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -147.5 156.97 43.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.403 177.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 27.4 m -144.52 -172.38 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.091 0 C-N-CA 123.972 0.909 . . . . 0.0 110.002 -176.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -57.21 163.01 2.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.293 0.637 . . . . 0.0 112.283 -178.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -143.88 26.96 1.51 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.779 0.832 . . . . 0.0 110.652 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -57.79 164.72 2.0 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 123.784 0.834 . . . . 0.0 111.805 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -143.2 23.31 1.85 Allowed 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.713 0.805 . . . . 0.0 111.205 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -67.88 16.91 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.77 1.228 . . . . 0.0 113.895 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -140.7 151.61 44.66 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.408 0.549 . . . . 0.0 110.476 -178.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -64.42 -25.65 68.11 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.968 0.507 . . . . 0.0 112.136 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.48 -34.69 60.14 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.63 -18.54 60.54 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 117.325 0.562 . . . . 0.0 110.865 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.63 -41.15 27.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 62.0 mt -71.02 -41.56 70.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.255 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -70.84 -25.9 63.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.928 -0.482 . . . . 0.0 111.314 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 45.5 t -64.74 -44.82 88.89 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.791 0.723 . . . . 0.0 109.769 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.4 -24.62 65.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -105.36 -1.51 25.02 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 122.088 -0.382 . . . . 0.0 111.62 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -79.79 -40.09 29.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -66.88 -16.88 64.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 175.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -88.01 -8.34 55.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.371 0.668 . . . . 0.0 112.496 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 7.2 tp -123.22 -7.95 7.88 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 CA-C-N 119.334 0.97 . . . . 0.0 112.909 -173.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -80.6 33.62 0.31 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.173 0.589 . . . . 0.0 112.036 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -130.87 175.57 8.95 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.113 0.482 . . . . 0.0 111.918 -174.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -64.04 178.05 0.71 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.704 1.201 . . . . 0.0 112.747 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.59 156.04 74.96 Favored Pre-proline 0 CA--C 1.53 0.192 0 C-N-CA 122.918 0.487 . . . . 0.0 110.998 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -77.67 -178.86 4.92 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.577 2.851 . . . . 0.0 110.044 173.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -148.65 -1.9 0.5 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -66.51 -20.49 66.04 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.939 -0.476 . . . . 0.0 111.905 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 3.1 mpp? -67.93 -36.81 80.77 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 82.6 mt -83.43 -12.46 56.38 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.117 -0.364 . . . . 0.0 110.213 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -72.43 -20.57 61.39 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.937 -0.477 . . . . 0.0 109.882 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -73.63 -19.57 60.82 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 173.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.468 ' C ' ' H ' ' B' ' 54' ' ' LYS . 15.8 mt -78.93 -22.6 45.53 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.136 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -73.41 9.38 1.35 Allowed 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 172.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.468 ' H ' ' C ' ' B' ' 52' ' ' LEU . 36.9 ttpt -120.72 -0.55 10.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.064 1.346 . . . . 0.0 110.588 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.2 pp -149.65 -15.36 0.27 Allowed 'General case' 0 C--N 1.345 0.374 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -122.65 5.63 9.49 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.668 0.667 . . . . 0.0 112.399 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . 0.546 ' HG ' ' H ' ' B' ' 58' ' ' GLU . 14.7 tp 56.01 -173.02 0.06 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.304 1.042 . . . . 0.0 111.604 179.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . 0.546 ' H ' ' HG ' ' B' ' 57' ' ' LEU . 44.1 mt-10 -128.47 9.7 6.09 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.782 0.833 . . . . 0.0 111.038 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 95.2 mt -146.45 168.4 21.27 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.756 1.222 . . . . 0.0 108.83 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 39.9 t -144.02 134.6 12.18 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.61 172.64 15.79 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.798 2.999 . . . . 0.0 111.423 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 51.4 tpt85 . . . . . 0 C--N 1.338 0.093 0 C-N-CA 123.434 0.694 . . . . 0.0 110.089 179.277 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 ttp . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m 47.33 28.68 1.1 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.679 1.191 . . . . 0.0 113.714 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.6 tp -63.42 -30.56 71.67 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 122.186 -0.321 . . . . 0.0 111.488 -177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -65.66 -35.42 91.06 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.3 mp0 -73.4 3.33 6.11 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.399 0.68 . . . . 0.0 111.115 177.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -128.42 0.58 5.65 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.283 0.633 . . . . 0.0 111.078 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.66 -39.54 2.74 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.952 0.501 . . . . 0.0 111.091 177.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.99 -44.78 99.62 Favored Pre-proline 0 CA--C 1.53 0.209 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -175.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -75.71 3.48 5.93 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.173 1.916 . . . . 0.0 111.907 -179.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -130.28 9.42 5.19 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.9 mt -54.86 -44.24 99.29 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.58 -15.0 11.24 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 121.715 1.61 . . . . 0.0 112.708 -175.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -71.59 -25.33 62.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.462 0.573 . . . . 0.0 111.221 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.9 mt -69.53 -27.32 65.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 118.145 0.429 . . . . 0.0 110.009 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -88.76 -29.18 19.98 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.53 0.732 . . . . 0.0 110.544 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.5 ttp180 -53.83 -25.58 20.2 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.674 1.19 . . . . 0.0 112.759 -175.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -140.56 -20.98 0.83 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.25 -27.99 70.09 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -69.26 -33.01 72.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 117.557 0.679 . . . . 0.0 110.289 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.95 -11.44 59.9 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.0 mt -86.07 4.39 38.34 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.03 0.377 . . . . 0.0 111.213 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.8 t -149.31 -18.13 0.28 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.97 11.24 82.87 Favored Glycine 0 CA--C 1.526 0.719 0 CA-C-O 119.47 -0.628 . . . . 0.0 113.75 171.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -148.28 140.03 23.79 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.349 1.075 . . . . 0.0 110.864 -179.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -73.36 -19.22 61.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.365 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -73.72 -37.68 65.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 178.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -79.67 -32.59 41.49 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 176.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.4 -47.1 82.49 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.81 -33.02 74.73 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.594 0.697 . . . . 0.0 110.313 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HE3' ' CE1' ' A' ' 31' ' ' TYR . 5.9 tmmm? -67.5 -46.78 71.93 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.63 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.476 ' CE1' ' HE3' ' A' ' 30' ' ' LYS . 22.7 m-85 -69.06 -36.07 77.24 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.392 0.542 . . . . 0.0 111.552 -178.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 t -60.81 -52.25 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -77.29 -27.83 53.14 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 122.423 -0.173 . . . . 0.0 111.375 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -24.24 63.23 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.721 -0.181 . . . . 0.0 110.847 175.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.0 m -67.82 -40.08 83.83 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.59 -42.25 61.81 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -59.63 -25.49 64.71 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.995 -0.44 . . . . 0.0 111.858 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 0.49 31.33 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.797 0.439 . . . . 0.0 111.011 178.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 81.6 mt -120.9 -13.89 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -61.79 -10.64 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.87 0.868 . . . . 0.0 111.708 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.7 3.0 9.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.001 0.52 . . . . 0.0 111.296 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.1 55.36 0.97 Allowed Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.385 0.674 . . . . 0.0 110.304 -177.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.47 -10.63 28.45 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 123.318 2.679 . . . . 0.0 112.753 -173.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -81.52 -11.69 59.09 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 122.067 -0.395 . . . . 0.0 111.005 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -86.73 -14.61 41.92 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -65.31 114.9 17.26 Favored Pre-proline 0 CA--C 1.529 0.165 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -78.78 135.29 12.64 Favored 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 122.991 2.461 . . . . 0.0 112.193 -174.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -125.76 1.91 7.45 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 125.054 1.342 . . . . 0.0 109.976 175.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -79.42 9.56 4.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.086 0.954 . . . . 0.0 111.719 -178.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.3 m -137.93 -179.08 2.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 C-N-CA 123.846 0.858 . . . . 0.0 109.967 -176.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -52.65 152.96 6.07 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.301 0.641 . . . . 0.0 110.81 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.78 7.3 0.59 Allowed 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.383 3.389 . . . . 0.0 112.588 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -127.17 -25.02 3.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.221 0.608 . . . . 0.0 110.843 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 28.7 mt -70.31 -33.9 72.08 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.039 0.381 . . . . 0.0 110.648 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.97 -41.0 93.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.62 -42.47 91.5 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.975 0.51 . . . . 0.0 109.977 177.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -77.47 -30.25 53.07 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -175.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -66.12 -41.99 89.76 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.71 0.687 . . . . 0.0 110.754 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.1 mmm -71.12 -34.76 71.37 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.502 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -71.0 -35.07 71.94 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 117.618 0.19 . . . . 0.0 110.752 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.25 -27.65 68.8 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.516 0.326 . . . . 0.0 110.204 177.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -72.71 -36.39 58.23 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -70.59 -38.24 72.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.101 0 CA-C-N 117.657 0.729 . . . . 0.0 110.142 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 76.0 t90 -69.29 -32.04 70.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 122.251 -0.281 . . . . 0.0 110.897 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.82 -32.94 68.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 122.099 -0.376 . . . . 0.0 110.179 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -74.11 -25.49 59.81 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.597 0.359 . . . . 0.0 110.484 178.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.38 65.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 122.392 -0.192 . . . . 0.0 110.626 179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -69.79 -16.52 63.3 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.115 -0.366 . . . . 0.0 110.614 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.48 7.51 46.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.23 0.612 . . . . 0.0 111.208 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -134.24 -4.89 2.68 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 111.66 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 112.88 25.56 4.46 Favored Glycine 0 C--N 1.341 0.825 0 C-N-CA 120.911 -0.662 . . . . 0.0 114.372 173.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -128.64 171.53 12.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.558 1.179 . . . . 0.0 110.637 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 51.01 25.69 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.195 0.998 . . . . 0.0 112.576 -176.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -67.51 -7.19 23.85 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -152.42 -19.87 0.17 Allowed 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.292 0.496 . . . . 0.0 111.706 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.0 m 49.85 26.4 1.92 Allowed 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -56.54 153.12 10.63 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.767 0.427 . . . . 0.0 110.071 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.4 p -136.47 170.68 15.66 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.791 0.436 . . . . 0.0 110.922 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -152.92 23.3 0.57 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.946 0.498 . . . . 0.0 111.291 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.72 162.03 2.51 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.958 -0.464 . . . . 0.0 111.734 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.25 -13.55 62.33 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -173.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.62 20.39 0.06 OUTLIER Glycine 0 CA--C 1.527 0.791 0 CA-C-O 119.421 -0.655 . . . . 0.0 113.448 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 8.9 t -134.18 5.45 3.54 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.304 1.052 . . . . 0.0 112.322 -176.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -150.97 -30.1 0.19 Allowed 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.42 -22.79 65.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.6 p -71.53 -29.9 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.586 0.354 . . . . 0.0 110.328 176.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.71 7.7 28.94 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.774 0.83 . . . . 0.0 111.568 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -127.97 -40.37 1.7 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.389 0.676 . . . . 0.0 110.062 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.2 -1.77 8.76 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.525 0.33 . . . . 0.0 111.786 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 63.6 mtt180 -130.84 -3.0 4.1 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 123.022 0.529 . . . . 0.0 111.926 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.47 ' C ' ' H ' ' A' ' 93' ' ' ARG . 73.6 mt -136.35 14.59 3.24 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.362 0.528 . . . . 0.0 111.51 -172.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.79 18.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.424 1.09 . . . . 0.0 112.124 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.47 ' H ' ' C ' ' A' ' 91' ' ' LEU . 85.2 mmt-85 -126.34 11.28 7.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.373 0.669 . . . . 0.0 112.064 -174.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 20.4 ptp -122.78 164.5 18.24 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 117.921 0.328 . . . . 0.0 110.304 175.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.41 ' C ' ' H ' ' A' ' 97' ' ' LEU . 63.5 m -62.45 143.29 96.09 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 123.258 0.623 . . . . 0.0 110.286 -176.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -53.06 -0.62 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 124.95 3.767 . . . . 0.0 115.139 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.41 ' H ' ' C ' ' A' ' 95' ' ' THR . 31.1 tp -119.47 -19.44 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.406 0.548 . . . . 0.0 110.564 -179.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.6 m -69.1 -27.72 65.85 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 mtp-105 -69.9 -26.79 64.33 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.525 0.33 . . . . 0.0 110.16 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -81.06 -39.34 25.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.13 -34.36 77.88 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.15 -49.26 68.03 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.557 0.343 . . . . 0.0 110.812 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.71 -4.65 35.8 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.7 tp -106.64 -4.44 19.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.817 0.447 . . . . 0.0 111.772 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 72.8 p -140.11 5.02 2.08 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.9 -1.06 6.61 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.587 0.631 . . . . 0.0 112.541 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 8.3 ptp -150.71 12.27 0.69 Allowed 'General case' 0 C--N 1.338 0.091 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -179.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -143.75 -12.26 0.67 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.723 0.692 . . . . 0.0 111.995 176.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 67.2 15.07 64.92 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.994 -0.892 . . . . 0.0 114.135 173.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -60.93 146.68 45.91 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.844 1.322 . . . . 0.0 110.231 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.7 m -65.98 153.51 91.46 Favored Pre-proline 0 N--CA 1.454 -0.24 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.51 -17.26 43.56 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.555 2.17 . . . . 0.0 111.24 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -74.93 -34.39 62.1 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 117.847 0.294 . . . . 0.0 110.711 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -82.26 -34.54 28.73 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.0 -27.48 67.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.437 0.295 . . . . 0.0 110.698 175.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.71 -32.91 53.23 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.46 -23.53 62.71 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.397 0.679 . . . . 0.0 111.213 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -88.82 -5.32 58.12 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 16.9 pt -135.13 12.07 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 O-C-N 121.875 -0.515 . . . . 0.0 111.071 176.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 54.42 58.22 5.12 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.898 1.279 . . . . 0.0 113.566 176.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.47 -178.71 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.807 0.843 . . . . 0.0 109.816 176.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -83.96 160.79 20.98 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.3 m -58.67 -36.96 74.99 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 122.018 -0.427 . . . . 0.0 110.912 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 97.6 p -72.66 -20.93 61.16 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -76.27 -33.38 59.12 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 121.97 -0.456 . . . . 0.0 110.084 178.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.9 t -66.22 -37.56 79.98 Favored 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.69 -32.19 73.22 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.444 0.164 . . . . 0.0 110.858 177.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.4 m -76.1 -39.43 55.27 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.515 177.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.44 -33.78 76.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.224 -0.417 . . . . 0.0 111.456 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.2 m -78.5 -26.44 13.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.138 0 CA-C-N 118.765 0.711 . . . . 0.0 111.12 177.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 60.7 m -68.45 -40.08 81.22 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.1 -27.42 60.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.8 -48.68 36.0 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 122.473 -0.142 . . . . 0.0 110.653 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 117.909 0.322 . . . . 0.0 111.731 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.82 -41.0 62.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 174.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -72.35 -22.24 61.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 119.513 -0.279 . . . . 0.0 110.461 178.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.7 mm -75.29 -44.3 42.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.514 0.597 . . . . 0.0 109.745 176.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -69.51 -20.48 63.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -94.7 -8.02 38.99 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -172.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -155.29 -12.06 0.11 Allowed 'General case' 0 C--N 1.34 0.193 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -175.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 41.1 p -64.2 -14.24 54.08 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 119.941 1.246 . . . . 0.0 112.354 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.89 2.78 16.28 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -145.62 175.45 10.36 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.4 0.68 . . . . 0.0 110.065 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.43 13.29 0.65 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -177.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -140.19 167.62 21.7 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.053 0.454 . . . . 0.0 111.157 -178.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 37.6 tp -156.56 168.46 27.3 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.202 1.001 . . . . 0.0 108.682 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 30.6 m -139.35 153.77 71.21 Favored Pre-proline 0 CA--C 1.531 0.233 0 C-N-CA 123.034 0.534 . . . . 0.0 110.129 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.98 172.78 14.76 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 123.992 3.128 . . . . 0.0 111.461 178.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 40.0 ptt180 -152.75 -178.87 7.15 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.793 0.837 . . . . 0.0 110.156 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -163.48 175.81 39.68 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 89.5 p -152.77 15.79 0.57 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.944 0.497 . . . . 0.0 111.399 -177.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 66.1 t60 53.22 21.03 2.06 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.696 0.798 . . . . 0.0 111.913 -175.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 54.4 m80 52.22 20.41 1.34 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.656 1.182 . . . . 0.0 113.216 -178.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 47.7 t60 -150.01 10.52 0.71 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.708 0.403 . . . . 0.0 111.057 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 60.2 t60 52.65 21.38 1.84 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.48 1.112 . . . . 0.0 112.463 -177.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -70.68 -8.49 52.36 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.23 0.612 . . . . 0.0 111.768 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 77.0 t60 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 117.157 -1.402 . . . . 0.0 110.102 -179.399 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -152.37 20.36 0.64 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.862 0.465 . . . . 0.0 111.946 -177.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -132.31 11.27 4.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.62 159.6 59.78 Favored Pre-proline 0 CA--C 1.533 0.303 0 O-C-N 121.854 -0.529 . . . . 0.0 109.666 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.3 -22.86 12.4 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 124.083 3.189 . . . . 0.0 113.679 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 165.35 164.32 20.51 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 110.859 -0.896 . . . . 0.0 110.859 176.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -160.8 -28.91 0.06 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 122.813 0.445 . . . . 0.0 111.266 178.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -156.52 17.69 0.33 Allowed 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.971 0.508 . . . . 0.0 111.724 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -140.17 15.48 2.43 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.634 0.374 . . . . 0.0 111.245 -175.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -142.13 -8.67 0.9 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.838 0.455 . . . . 0.0 111.043 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 49.36 19.61 0.36 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.149 1.38 . . . . 0.0 113.266 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -157.22 155.63 31.18 Favored 'General case' 0 C--N 1.333 -0.137 0 O-C-N 122.066 -0.396 . . . . 0.0 111.02 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 80.2 p -160.12 0.26 0.07 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.846 0.458 . . . . 0.0 112.068 177.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 44.8 m -145.35 13.46 1.4 Allowed 'General case' 0 C--N 1.342 0.242 0 C-N-CA 122.756 0.422 . . . . 0.0 112.025 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -76.08 33.07 0.12 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.269 0.628 . . . . 0.0 112.254 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -140.63 163.91 31.59 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 123.688 0.795 . . . . 0.0 110.081 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 55.7 p -154.63 54.1 0.99 Allowed Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -177.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.61 169.87 17.7 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.778 2.319 . . . . 0.0 110.395 177.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -149.55 177.55 9.63 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.851 0.358 . . . . 0.0 111.557 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -154.4 21.53 0.48 Allowed 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.777 0.831 . . . . 0.0 111.606 -173.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 34.3 m -134.66 179.02 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 C-N-CA 123.308 0.643 . . . . 0.0 110.925 -174.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 25.8 pt20 -56.94 165.3 1.29 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.896 0.878 . . . . 0.0 112.757 -178.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 9.4 t -149.55 23.28 0.9 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.576 0.75 . . . . 0.0 110.469 -178.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -137.12 174.03 11.06 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 123.666 0.787 . . . . 0.0 110.001 -177.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.59 3.06 1.11 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -152.42 136.92 16.8 Favored 'General case' 0 C--N 1.339 0.128 0 O-C-N 122.19 -0.319 . . . . 0.0 110.376 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -160.54 4.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.148 0.579 . . . . 0.0 111.562 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.7 tpt -58.5 -26.6 63.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -70.43 -34.24 68.28 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.8 -22.16 43.41 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 117.285 0.543 . . . . 0.0 110.541 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.98 71.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.816 0.341 . . . . 0.0 110.099 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 90.7 mt -74.78 -31.62 61.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.219 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -67.72 -37.66 82.53 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 117.94 0.336 . . . . 0.0 110.42 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -65.86 -37.23 85.64 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.833 0.288 . . . . 0.0 110.499 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.74 -29.12 68.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -102.23 -14.08 17.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 O-C-N 122.083 -0.386 . . . . 0.0 111.585 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -66.99 -36.76 82.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.78 -31.96 70.16 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.621 0.368 . . . . 0.0 110.791 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 96.1 m -73.68 -8.95 58.02 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.228 0.611 . . . . 0.0 112.327 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.441 ' C ' ' H ' ' B' ' 42' ' ' GLU . 16.7 tt -123.54 -7.18 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 118.77 0.714 . . . . 0.0 111.776 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.11 24.38 0.13 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.406 -0.809 . . . . 0.0 110.714 171.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.441 ' H ' ' C ' ' B' ' 40' ' ' ILE . 81.6 mm-40 -131.94 171.92 12.98 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.485 0.714 . . . . 0.0 111.179 -175.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -67.54 -177.34 0.73 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.399 1.079 . . . . 0.0 112.113 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 35.2 m -132.39 150.36 75.72 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.809 0.844 . . . . 0.0 109.231 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.29 -25.98 5.39 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.169 2.58 . . . . 0.0 113.051 -175.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 51.89 4.07 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.881 1.272 . . . . 0.0 114.015 -176.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -66.0 -22.12 66.44 Favored 'General case' 0 CA--C 1.528 0.108 0 O-C-N 121.461 -0.774 . . . . 0.0 111.243 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 27.6 mtm -70.71 -34.2 71.68 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.661 0.384 . . . . 0.0 111.017 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 71.7 mt -82.52 -15.03 53.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.888 -0.507 . . . . 0.0 109.884 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -70.31 -20.49 63.01 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.995 -0.441 . . . . 0.0 109.837 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.03 -14.7 61.47 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.192 -0.318 . . . . 0.0 110.655 173.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.483 ' C ' ' H ' ' B' ' 54' ' ' LYS . 31.1 mt -86.72 -20.93 26.97 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.093 173.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -69.84 16.23 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.705 0.402 . . . . 0.0 111.928 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.483 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -135.04 5.41 3.3 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.724 0.81 . . . . 0.0 111.175 177.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 pp -151.52 -2.73 0.31 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 177.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -144.48 170.01 16.87 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.426 0.557 . . . . 0.0 110.101 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -153.95 140.4 18.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -178.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -147.75 160.83 42.3 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.414 0.686 . . . . 0.0 109.926 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 97.0 mt -146.47 175.58 10.45 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.646 0.778 . . . . 0.0 110.132 -175.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 14.6 p -149.66 140.33 14.02 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -70.53 167.05 26.55 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.014 2.476 . . . . 0.0 111.405 178.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 51.3 tpt85 . . . . . 0 N--CA 1.457 -0.1 0 C-N-CA 123.301 0.641 . . . . 0.0 110.403 -179.826 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.4 t -154.58 165.54 36.16 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.516 0.726 . . . . 0.0 109.409 178.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.6 tp -60.98 -35.75 77.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 121.974 0.11 . . . . 0.0 111.099 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.85 -29.16 67.63 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.168 -177.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -74.91 0.91 14.1 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.545 0.738 . . . . 0.0 110.251 176.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -137.12 8.37 2.95 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.419 1.088 . . . . 0.0 110.687 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.6 tp -118.31 -38.89 3.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.223 0.609 . . . . 0.0 110.622 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.58 97.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -74.09 -0.22 9.27 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.282 1.988 . . . . 0.0 112.631 -176.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.409 ' CE1' ' HE ' ' A' ' 53' ' ' ARG . 39.1 m-70 -133.67 3.17 3.52 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.017 0.527 . . . . 0.0 111.158 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.2 tp -59.64 -43.49 95.63 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 124.632 1.173 . . . . 0.0 113.786 -177.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -75.0 -10.67 21.32 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.741 1.628 . . . . 0.0 112.367 -176.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-30 -66.57 -22.59 66.14 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.594 0.634 . . . . 0.0 111.365 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -74.05 -17.15 61.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.209 -0.307 . . . . 0.0 110.557 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.7 ttt85 -105.06 -26.25 12.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.763 0.425 . . . . 0.0 111.221 -175.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -61.68 -19.6 62.52 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 122.877 0.471 . . . . 0.0 111.647 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -136.83 -11.88 1.75 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.423 0.289 . . . . 0.0 111.143 175.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.27 -38.64 96.55 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 177.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.9 mtm105 -68.69 -24.9 64.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.105 0.953 . . . . 0.0 110.423 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.42 4.15 36.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.691 0.797 . . . . 0.0 111.253 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 tp -126.74 4.59 6.69 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.979 0.912 . . . . 0.0 110.297 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.3 p -135.81 -9.52 2.1 Favored 'General case' 0 C--N 1.338 0.078 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.76 2.36 44.41 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-O 119.494 -0.615 . . . . 0.0 114.093 173.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 t -157.03 140.08 15.38 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.262 1.031 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -66.54 -20.99 66.16 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.207 177.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -78.81 -32.03 46.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -79.01 -40.24 31.98 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.45 -32.31 83.72 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -71.88 -39.71 69.43 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 117.129 0.465 . . . . 0.0 111.264 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -26.43 30.77 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 120.458 -0.497 . . . . 0.0 112.122 -177.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -69.17 -35.43 76.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 119.097 0.862 . . . . 0.0 110.059 176.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.0 t -65.01 -43.71 96.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.147 0 CA-C-O 120.643 0.259 . . . . 0.0 110.526 176.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.3 ttp-105 -78.76 -28.48 44.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 122.302 -0.249 . . . . 0.0 111.661 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.57 -29.73 65.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 65.0 m -65.15 -37.88 88.82 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.8 -42.72 32.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -177.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -63.41 -24.66 67.94 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.795 -0.565 . . . . 0.0 110.475 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.14 -0.08 26.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.406 0.682 . . . . 0.0 111.528 176.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 92.2 mt -120.24 -15.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.836 0.854 . . . . 0.0 109.696 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.02 -14.37 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.367 0.667 . . . . 0.0 110.775 173.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.85 4.41 9.43 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.679 0.792 . . . . 0.0 110.937 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.28 55.5 1.41 Allowed Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.33 0.652 . . . . 0.0 111.494 -177.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -68.43 -4.72 13.48 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.368 2.045 . . . . 0.0 110.868 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -85.81 4.11 38.53 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.2 1.0 . . . . 0.0 111.662 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -131.26 20.88 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.119 0.418 . . . . 0.0 111.358 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -131.83 53.67 12.09 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.457 0.703 . . . . 0.0 110.073 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.77 171.72 17.67 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.148 3.232 . . . . 0.0 112.752 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.45 ' C ' ' H ' ' A' ' 50' ' ' VAL . 5.1 mpt_? -113.08 18.82 17.72 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.179 1.392 . . . . 0.0 110.126 175.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.09 4.41 0.9 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.989 0.916 . . . . 0.0 110.809 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.45 ' H ' ' C ' ' A' ' 48' ' ' ARG . 30.4 m -135.73 177.75 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 125.462 1.505 . . . . 0.0 108.494 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.411 ' C ' ' H ' ' A' ' 53' ' ' ARG . 14.0 m-20 -57.93 148.47 59.46 Favored Pre-proline 0 C--O 1.232 0.173 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.33 10.69 0.53 Allowed 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.793 2.995 . . . . 0.0 111.666 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.411 ' H ' ' C ' ' A' ' 51' ' ' ASP . 98.9 mtt180 -126.52 -16.67 5.27 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 124.029 0.932 . . . . 0.0 110.613 177.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -45.3 64.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.47 -32.83 82.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.68 -50.08 74.38 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.227 -0.656 . . . . 0.0 109.227 178.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -76.71 -29.64 56.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.572 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -68.14 -42.03 80.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 119.671 -0.204 . . . . 0.0 111.145 -176.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.4 mmm -79.41 -31.31 42.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.994 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -68.02 -38.82 83.01 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.939 0.336 . . . . 0.0 110.212 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 tm0? -70.74 -25.2 62.82 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 122.506 0.322 . . . . 0.0 110.199 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.77 -39.75 85.66 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -72.34 -36.75 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.109 0 CA-C-N 118.194 0.997 . . . . 0.0 109.698 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -68.71 -35.61 77.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.522 -0.111 . . . . 0.0 110.916 -177.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.44 -31.12 66.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 176.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -72.48 -28.01 62.64 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.05 -36.7 58.93 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.384 -0.198 . . . . 0.0 110.549 177.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -73.51 -14.07 61.15 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.298 -0.251 . . . . 0.0 110.488 175.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.18 9.49 39.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.426 0.691 . . . . 0.0 110.458 176.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.3 -8.52 3.35 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.076 0.551 . . . . 0.0 111.056 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 149.91 -22.46 1.14 Allowed Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.311 -0.716 . . . . 0.0 114.708 173.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.07 140.01 58.78 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.424 1.112 . . . . 0.0 110.771 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -174.54 15.65 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.655 0.782 . . . . 0.0 111.516 178.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -84.28 170.91 13.19 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.11 0.481 . . . . 0.0 110.699 -176.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -64.13 152.7 39.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.005 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.7 p -164.33 9.25 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -175.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -63.51 -11.02 20.72 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -169.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.7 p -158.7 167.59 29.12 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.944 0.793 . . . . 0.0 112.05 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -149.31 19.11 0.95 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.135 0.974 . . . . 0.0 110.522 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.29 -171.57 3.87 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.481 0.712 . . . . 0.0 109.918 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -134.02 12.11 3.94 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.802 0.441 . . . . 0.0 111.604 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -163.9 9.56 0.08 OUTLIER Glycine 0 CA--C 1.53 0.97 0 CA-C-O 119.702 -0.499 . . . . 0.0 114.054 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 t -148.0 -0.25 0.61 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.106 0.953 . . . . 0.0 111.71 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -141.95 -36.16 0.43 Allowed 'General case' 0 C--O 1.228 -0.056 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.05 -28.79 69.11 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.06 -32.39 54.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.738 0.304 . . . . 0.0 110.561 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.23 0.09 55.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.42 0.688 . . . . 0.0 112.296 -175.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -132.26 -12.21 3.18 Favored 'General case' 0 C--O 1.227 -0.119 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.3 -3.42 36.61 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 173.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 70.9 mtt85 -122.62 -12.49 8.11 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.75 0.82 . . . . 0.0 111.03 177.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' A' ' 93' ' ' ARG . 3.4 mm? -134.8 36.04 3.1 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.661 1.184 . . . . 0.0 110.085 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.404 ' C ' ' HD2' ' A' ' 93' ' ' ARG . . . -61.19 9.23 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.418 ' H ' ' C ' ' A' ' 91' ' ' LEU . 2.8 mpt_? -130.42 0.42 4.52 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.922 0.783 . . . . 0.0 111.798 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.5 ttm -69.28 144.07 53.69 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.569 0.622 . . . . 0.0 109.797 177.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.416 ' C ' ' H ' ' A' ' 97' ' ' LEU . 24.2 m -67.19 137.47 94.19 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 123.052 0.541 . . . . 0.0 110.74 -178.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.5 2.98 0.07 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 125.133 3.888 . . . . 0.0 115.448 176.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.416 ' H ' ' C ' ' A' ' 95' ' ' THR . 3.1 tm? -128.63 -33.75 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.816 0.735 . . . . 0.0 109.937 -176.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 51.0 m -64.91 -25.42 67.88 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 121.922 -0.486 . . . . 0.0 110.115 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -70.46 -29.56 66.15 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 122.563 0.345 . . . . 0.0 110.413 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -72.71 -37.85 67.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.66 -31.56 68.52 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.082 -0.386 . . . . 0.0 110.173 176.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.49 -47.01 77.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.17 -11.16 60.43 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.712 -0.617 . . . . 0.0 111.544 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 65.2 mt -91.4 -5.1 54.95 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.103 -0.373 . . . . 0.0 111.627 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 68.5 p -135.55 6.32 3.23 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.58 7.91 1.94 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.059 0.544 . . . . 0.0 111.229 177.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.6 mtm -146.61 -2.1 0.67 Allowed 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -176.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -150.18 -17.59 0.25 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.919 0.781 . . . . 0.0 112.17 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 74.4 16.31 79.97 Favored Glycine 0 C--N 1.34 0.784 0 CA-C-O 119.345 -0.697 . . . . 0.0 114.005 173.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -61.27 149.88 36.49 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.639 1.22 . . . . 0.0 110.192 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.8 m -73.73 156.0 88.65 Favored Pre-proline 0 C--O 1.232 0.162 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -53.15 -27.18 36.14 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 123.198 2.598 . . . . 0.0 113.248 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.13 -33.89 70.52 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.938 -0.476 . . . . 0.0 110.798 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -83.53 -35.54 24.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.66 -29.6 67.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.148 0.179 . . . . 0.0 111.351 178.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.18 -32.93 50.32 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.574 0.226 . . . . 0.0 110.662 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -69.11 -30.87 69.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 52.5 mt -75.51 -6.5 50.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 10.1 pt -135.24 11.2 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 118.796 0.725 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 53.78 56.18 7.51 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.857 1.263 . . . . 0.0 113.955 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.4 m -135.98 176.08 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 C-N-CA 123.455 0.702 . . . . 0.0 110.183 175.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -73.31 156.77 38.09 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 120.859 0.362 . . . . 0.0 110.333 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 33.3 m -60.48 -35.9 77.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 121.95 -0.469 . . . . 0.0 110.978 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 89.5 p -75.54 -21.3 58.05 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.976 -0.453 . . . . 0.0 111.512 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -74.44 -43.13 57.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.365 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.7 p -67.25 -29.6 46.41 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.221 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.38 -33.86 76.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.1 m -75.94 -36.23 59.43 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.4 -35.1 79.48 Favored 'General case' 0 CA--C 1.527 0.094 0 O-C-N 122.195 -0.315 . . . . 0.0 111.546 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.7 m -79.15 -26.59 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 118.442 0.564 . . . . 0.0 111.02 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 51.9 m -67.13 -35.49 79.85 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -81.01 -25.06 37.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.478 -0.139 . . . . 0.0 110.873 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.83 -43.6 68.22 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 122.189 -0.319 . . . . 0.0 110.229 179.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -74.84 -22.23 58.81 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.177 0.191 . . . . 0.0 110.748 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.37 -34.84 73.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -75.73 -22.89 56.13 Favored 'General case' 0 N--CA 1.457 -0.116 0 O-C-N 122.289 -0.257 . . . . 0.0 110.54 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.0 mm -73.49 -52.52 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.148 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -69.83 -20.5 63.43 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -175.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -72.02 -20.69 61.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.522 ' C ' ' H ' ' A' ' 142' ' ' ARG . 22.4 pt20 -154.06 -37.82 0.1 Allowed 'General case' 0 N--CA 1.458 -0.067 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -173.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 56.4 p 47.26 -9.61 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.274 1.83 . . . . 0.0 115.796 -168.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.522 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.1 OUTLIER -165.98 -33.64 0.03 OUTLIER 'General case' 0 C--N 1.342 0.247 0 CA-C-N 119.914 1.234 . . . . 0.0 112.367 172.313 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . 0.444 ' H ' ' HD3' ' A' ' 142' ' ' ARG . . . -171.48 171.87 5.31 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.393 0.677 . . . . 0.0 110.465 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.79 157.68 42.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.622 0.769 . . . . 0.0 109.36 175.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -154.71 10.21 0.35 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.039 0.136 . . . . 0.0 111.34 -176.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 58.2 tp -146.09 112.36 5.81 Favored 'General case' 0 N--CA 1.456 -0.138 0 O-C-N 121.717 -0.615 . . . . 0.0 110.542 -177.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 25.1 t -146.35 77.15 11.81 Favored Pre-proline 0 CA--C 1.53 0.208 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 178.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.42 6.1 1.03 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 124.673 3.582 . . . . 0.0 113.387 -172.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 94.7 mtm-85 -138.25 21.45 2.78 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.14 0.576 . . . . 0.0 111.328 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -161.17 20.31 0.21 Allowed Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.191 -0.783 . . . . 0.0 113.562 -177.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 73.7 m -140.61 10.99 2.27 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.357 1.079 . . . . 0.0 112.478 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 28.8 p80 -152.51 171.09 18.64 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.076 0.398 . . . . 0.0 110.733 178.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -144.07 5.41 1.31 Allowed 'General case' 0 C--O 1.232 0.156 0 C-N-CA 123.357 0.663 . . . . 0.0 111.067 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -156.22 164.55 38.22 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.313 0.645 . . . . 0.0 109.892 -178.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -154.61 172.04 18.5 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 122.877 0.471 . . . . 0.0 110.767 -178.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -146.61 7.08 0.96 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.959 0.504 . . . . 0.0 110.953 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 63.1 m80 . . . . . 0 C--O 1.253 1.242 0 CA-C-O 117.122 -1.418 . . . . 0.0 110.201 -178.042 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.477 0.88 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 20.3 tp -147.08 8.89 0.96 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.654 0.381 . . . . 0.0 110.829 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.1 t70 58.04 15.93 3.49 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.182 0.993 . . . . 0.0 112.791 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 7.3 mp -122.99 157.85 59.21 Favored Pre-proline 0 CA--C 1.529 0.161 0 C-N-CA 123.94 0.896 . . . . 0.0 109.056 177.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -73.11 -6.44 18.95 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 123.731 2.954 . . . . 0.0 112.178 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 174.62 173.79 40.81 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 178.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -154.39 -4.7 0.16 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 26.0 pttm 43.21 29.98 0.26 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.238 1.415 . . . . 0.0 113.846 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -150.4 168.0 25.43 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.03 0.532 . . . . 0.0 110.801 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -154.87 16.75 0.44 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 178.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -146.49 0.4 0.78 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -175.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.16 8.93 2.07 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.638 -0.664 . . . . 0.0 111.328 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 84.6 p -150.34 12.13 0.72 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.185 0.594 . . . . 0.0 111.056 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 28.9 t -148.81 170.53 18.02 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.534 0.733 . . . . 0.0 109.464 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -151.53 163.3 39.33 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.813 0.445 . . . . 0.0 110.116 -176.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -60.32 166.88 2.74 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.856 0.862 . . . . 0.0 110.372 177.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 31.2 t -137.21 145.13 48.66 Favored Pre-proline 0 N--CA 1.455 -0.183 0 C-N-CA 123.537 0.735 . . . . 0.0 109.621 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -74.16 5.12 3.76 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 124.039 3.159 . . . . 0.0 112.541 -179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . 57.78 -170.87 0.1 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.084 0.954 . . . . 0.0 112.377 -177.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 44.4 31.7 0.62 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.626 1.571 . . . . 0.0 113.465 -174.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 27.3 m -138.28 170.9 16.18 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.082 0 C-N-CA 123.961 0.904 . . . . 0.0 109.516 176.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 53.7 21.0 2.43 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.821 0.848 . . . . 0.0 112.205 -175.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 87.4 p -146.52 13.13 1.2 Allowed 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.648 0.779 . . . . 0.0 111.109 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.97 14.78 2.87 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 124.312 1.045 . . . . 0.0 110.756 -175.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -65.35 -11.06 38.41 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.056 0.542 . . . . 0.0 111.715 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 44.9 ttm105 -161.07 143.55 12.46 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.309 0.643 . . . . 0.0 110.009 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -150.27 17.91 0.84 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.615 0.766 . . . . 0.0 110.882 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.1 tpt -54.13 -35.06 61.79 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.18 -37.19 94.11 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.97 -15.6 58.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.36 -0.494 . . . . 0.0 111.254 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.3 -58.11 3.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . 0.407 ' H ' ' CD2' ' B' ' 32' ' ' LEU . 1.9 pt? -81.51 -13.25 58.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.489 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -69.5 -35.6 75.69 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.582 0.628 . . . . 0.0 109.408 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 36.4 t -66.54 -35.41 80.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.7 -31.76 72.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 110.923 175.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -87.39 -20.86 26.09 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 121.759 -0.588 . . . . 0.0 111.059 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -69.51 -36.03 76.09 Favored 'General case' 0 CA--C 1.526 0.027 0 CA-C-N 118.447 0.567 . . . . 0.0 111.131 -178.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -67.03 -16.69 64.52 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 118.057 0.389 . . . . 0.0 111.115 178.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -79.16 -13.31 59.8 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 110.56 -0.163 . . . . 0.0 110.56 173.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.47 ' C ' ' H ' ' B' ' 42' ' ' GLU . 30.8 mm -102.46 -18.45 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 118.213 0.461 . . . . 0.0 111.052 -178.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -74.88 28.92 0.09 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.596 0.758 . . . . 0.0 110.663 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.47 ' H ' ' C ' ' B' ' 40' ' ' ILE . 80.6 mm-40 -137.67 177.62 7.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.084 0.954 . . . . 0.0 110.794 -174.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -65.82 179.33 0.88 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.889 0.876 . . . . 0.0 111.489 177.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.42 151.52 74.89 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.074 0.55 . . . . 0.0 110.173 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.07 79.15 3.47 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.091 3.194 . . . . 0.0 110.869 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.43 -3.77 0.49 Allowed 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -61.25 -23.77 65.89 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.766 -0.584 . . . . 0.0 112.179 179.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -69.26 -33.63 73.54 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 118.268 0.485 . . . . 0.0 110.211 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 78.7 mt -83.51 -13.03 55.51 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.89 -0.506 . . . . 0.0 110.561 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -71.12 -23.47 62.1 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.58 -17.89 61.13 Favored 'General case' 0 CA--C 1.523 -0.072 0 C-N-CA 122.741 0.417 . . . . 0.0 110.804 174.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.485 ' C ' ' H ' ' B' ' 54' ' ' LYS . 37.2 mt -90.59 -14.76 31.85 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.317 -0.24 . . . . 0.0 110.889 173.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -72.35 18.54 0.09 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.062 0.945 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.485 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.6 pttt -137.14 6.11 2.82 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.472 1.109 . . . . 0.0 110.978 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -149.31 -18.5 0.28 Allowed 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.25 -8.65 56.73 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.314 0.506 . . . . 0.0 112.02 178.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 1.4 mm? 54.01 176.38 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.309 1.444 . . . . 0.0 113.447 -176.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -158.4 175.45 13.7 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.529 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -148.08 163.81 35.77 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.734 0.813 . . . . 0.0 110.424 177.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.8 p -155.24 142.75 13.95 Favored Pre-proline 0 CA--C 1.533 0.309 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -178.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.21 177.47 7.19 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 123.285 2.656 . . . . 0.0 110.902 175.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 . . . . . 0 CA--C 1.533 0.305 0 C-N-CA 124.72 1.208 . . . . 0.0 111.665 -179.02 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.3 mtp . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p -144.98 12.2 1.41 Allowed 'General case' 0 C--N 1.339 0.115 0 C-N-CA 122.689 0.396 . . . . 0.0 111.587 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.0 tp -54.92 -33.68 62.41 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.909 0.484 . . . . 0.0 111.755 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.49 -23.92 65.31 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.79 -0.569 . . . . 0.0 112.007 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -81.0 -0.4 39.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.427 0.613 . . . . 0.0 111.177 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -134.37 3.56 3.36 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.403 0.681 . . . . 0.0 110.432 -178.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.06 -41.65 5.31 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.873 0.869 . . . . 0.0 108.952 178.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.84 -43.5 91.85 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.69 -4.46 15.38 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.386 2.057 . . . . 0.0 113.284 -173.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -135.56 12.77 3.47 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.236 0.471 . . . . 0.0 110.801 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -56.03 -41.05 89.02 Favored Pre-proline 0 CA--C 1.537 0.474 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.49 -8.28 12.62 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 121.954 1.77 . . . . 0.0 112.466 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.92 -21.42 65.99 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.855 0.752 . . . . 0.0 110.834 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 63.4 mt -73.09 -18.98 61.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.795 0.27 . . . . 0.0 110.487 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.9 mtt-85 -97.93 -19.75 17.88 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -53.6 -27.24 25.59 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.88 1.272 . . . . 0.0 111.833 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.8 p90 -140.44 -14.86 0.97 Allowed 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.681 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.5 -29.73 75.93 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -70.77 -3.68 20.01 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.23 1.015 . . . . 0.0 112.037 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.32 6.36 7.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.631 0.772 . . . . 0.0 110.398 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.4 tp -107.96 6.63 27.37 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.293 1.037 . . . . 0.0 110.103 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.8 p -132.87 -19.28 2.31 Favored 'General case' 0 C--O 1.23 0.047 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.28 -2.84 87.39 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-O 119.672 -0.515 . . . . 0.0 112.712 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.6 t -157.92 139.26 13.54 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.214 1.007 . . . . 0.0 110.858 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -65.23 -20.1 66.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.42 -0.175 . . . . 0.0 111.184 178.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -72.99 -34.56 66.49 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 178.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -83.18 -29.02 28.91 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.226 -0.286 . . . . 0.0 110.226 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.52 -40.98 67.05 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.67 -33.67 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 117.434 0.617 . . . . 0.0 110.684 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -69.72 -45.92 67.11 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 119.469 -0.301 . . . . 0.0 111.448 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -67.65 -32.58 73.36 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.453 0.57 . . . . 0.0 111.248 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.6 t -63.94 -50.15 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 CA-C-N 118.173 0.442 . . . . 0.0 110.673 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -75.74 -27.38 58.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.974 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.8 -23.03 59.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.741 -0.171 . . . . 0.0 110.828 176.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.0 m -63.57 -48.0 79.21 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.58 -35.26 72.95 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.73 0.3 . . . . 0.0 110.333 -178.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -67.12 -16.66 64.46 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.876 -0.515 . . . . 0.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -87.39 -6.88 58.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.956 -0.465 . . . . 0.0 111.281 174.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 36.2 mm -98.36 -27.59 3.68 Favored 'Isoleucine or valine' 0 C--N 1.339 0.122 0 CA-C-N 117.856 0.298 . . . . 0.0 110.682 -179.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.0 m -66.69 -7.09 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -89.81 -15.83 31.48 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 118.077 0.399 . . . . 0.0 110.559 175.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -170.04 89.67 0.53 Allowed Pre-proline 0 CA--C 1.532 0.273 0 C-N-CA 124.199 1.0 . . . . 0.0 109.2 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.48 -5.97 15.35 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.029 2.486 . . . . 0.0 112.219 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.6 -14.51 59.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.497 0.319 . . . . 0.0 110.623 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -83.87 9.35 12.29 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.273 0.629 . . . . 0.0 111.352 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -130.54 79.97 71.13 Favored Pre-proline 0 N--CA 1.451 -0.412 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.43 157.59 61.17 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.303 2.669 . . . . 0.0 111.408 -173.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 7.46 2.77 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.256 1.022 . . . . 0.0 110.493 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.7 9.49 1.8 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.623 1.169 . . . . 0.0 110.835 174.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.2 m -131.77 -172.43 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 C-N-CA 124.509 1.123 . . . . 0.0 109.272 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' C ' ' H ' ' A' ' 53' ' ' ARG . 5.2 m-20 -58.43 148.98 62.55 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.26 13.19 0.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 124.169 3.246 . . . . 0.0 112.372 -177.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.407 ' H ' ' C ' ' A' ' 51' ' ' ASP . 0.9 OUTLIER -129.11 -16.95 3.95 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 119.312 -0.375 . . . . 0.0 111.371 175.707 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 18.4 mt -71.56 -39.03 70.91 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.649 0.659 . . . . 0.0 110.479 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.2 -39.02 94.34 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -54.3 47.77 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.541 0.736 . . . . 0.0 110.147 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -72.3 -36.29 68.89 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.81 -175.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 52.9 tpt85 -60.77 -41.84 96.31 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.617 0.644 . . . . 0.0 111.394 -174.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.8 mmm -81.38 -26.8 35.19 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.521 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -68.17 -38.0 81.59 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.686 0.676 . . . . 0.0 110.323 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -67.75 -24.79 65.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.47 0.308 . . . . 0.0 110.242 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.22 -37.89 71.81 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -72.25 -40.04 64.97 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 CA-C-N 117.985 0.892 . . . . 0.0 109.999 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -69.14 -35.58 76.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 122.555 -0.091 . . . . 0.0 110.825 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.86 -27.69 65.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 122.387 -0.196 . . . . 0.0 110.689 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.1 t -82.72 -18.14 41.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.286 0.234 . . . . 0.0 110.703 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -46.75 30.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.327 0.251 . . . . 0.0 110.823 -179.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -77.41 -15.89 59.11 Favored 'General case' 0 CA--C 1.527 0.09 0 O-C-N 122.276 -0.265 . . . . 0.0 111.211 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.71 2.03 24.26 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.412 0.685 . . . . 0.0 111.237 176.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -137.75 0.9 2.27 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.089 0.556 . . . . 0.0 111.362 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 87.41 5.94 78.48 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 119.728 -0.484 . . . . 0.0 113.327 175.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.65 -15.41 63.51 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.155 0.978 . . . . 0.0 111.405 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -160.11 153.77 22.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.726 0.81 . . . . 0.0 109.75 177.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -146.33 -9.4 0.5 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.699 0.4 . . . . 0.0 112.046 177.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -165.84 176.85 7.58 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.397 0.679 . . . . 0.0 109.681 -178.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.4 p -152.65 155.91 38.22 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.772 0.429 . . . . 0.0 110.464 177.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -157.26 162.28 39.2 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.8 m -139.0 165.54 26.86 Favored 'General case' 0 C--O 1.23 0.055 0 O-C-N 122.084 -0.385 . . . . 0.0 110.79 -177.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -149.34 25.92 0.87 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.879 0.472 . . . . 0.0 110.994 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.07 164.88 1.47 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.983 0.42 . . . . 0.0 111.307 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.97 -10.65 30.95 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -174.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 157.04 21.74 0.03 OUTLIER Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.255 -0.747 . . . . 0.0 113.437 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.5 t -137.51 6.73 2.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.423 1.111 . . . . 0.0 112.955 -175.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -143.03 -35.89 0.39 Allowed 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.709 0.403 . . . . 0.0 110.043 173.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.44 -27.06 67.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.8 p -66.56 -27.62 40.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 C-N-CA 122.536 0.334 . . . . 0.0 110.422 178.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.66 -0.45 55.17 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.013 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -130.29 -18.52 3.24 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 118.149 0.431 . . . . 0.0 112.087 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.1 -1.82 31.09 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.766 0.426 . . . . 0.0 110.543 174.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -130.24 -13.49 3.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.004 0.522 . . . . 0.0 112.317 -177.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.485 ' C ' ' H ' ' A' ' 93' ' ' ARG . 9.9 mp -129.68 15.51 5.92 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.481 0.713 . . . . 0.0 111.611 -172.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.33 9.51 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 177.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 91' ' ' LEU . 66.9 mtt85 -124.6 15.34 8.8 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.545 0.738 . . . . 0.0 110.892 -176.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 39.3 ttm -115.35 142.38 46.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.028 0.931 . . . . 0.0 109.467 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 98' ' ' SER . 5.7 t -68.04 140.42 93.49 Favored Pre-proline 0 CA--C 1.531 0.22 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -53.2 -22.73 20.63 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.968 3.112 . . . . 0.0 114.418 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -79.3 -46.27 18.04 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.031 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.478 ' H ' HG23 ' A' ' 95' ' ' THR . 55.6 m -67.81 -23.54 65.2 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.214 -0.304 . . . . 0.0 111.175 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.0 ttp180 -67.73 -33.32 74.63 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.22 -37.49 61.09 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 177.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.85 76.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 178.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.1 tp -61.78 -50.92 70.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.547 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 3.8 pp -79.44 0.88 27.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.8 tp -97.29 -6.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.231 -0.293 . . . . 0.0 111.391 177.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.8 p -140.53 -16.78 0.9 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -81.53 -12.89 58.66 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.465 1.03 . . . . 0.0 113.045 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.547 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 1.8 pmm? -154.08 14.9 0.47 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -129.58 -11.99 4.42 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.525 0.602 . . . . 0.0 112.052 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 68.51 7.55 53.57 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-O 118.887 -0.951 . . . . 0.0 114.761 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -58.39 150.34 22.52 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.354 1.577 . . . . 0.0 110.634 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.9 p -71.8 161.28 79.54 Favored Pre-proline 0 N--CA 1.454 -0.269 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.48 -16.49 47.5 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.059 1.84 . . . . 0.0 111.02 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -79.17 -45.05 20.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 117.884 0.311 . . . . 0.0 110.572 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -74.07 -32.0 63.08 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.54 -22.67 63.54 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.239 0.216 . . . . 0.0 110.991 177.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.11 -29.79 34.75 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.516 0.198 . . . . 0.0 110.694 179.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.3 -38.94 82.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.663 0.385 . . . . 0.0 111.333 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 57.0 mt -72.91 -4.06 29.61 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 12.5 pt -135.41 11.64 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 118.986 0.812 . . . . 0.0 111.281 177.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 52.03 59.57 4.44 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.905 1.282 . . . . 0.0 113.827 176.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.03 -178.42 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 123.521 0.728 . . . . 0.0 109.932 176.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -83.28 160.26 21.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 86.2 m -60.49 -37.56 81.49 Favored 'General case' 0 C--O 1.232 0.177 0 O-C-N 121.954 -0.466 . . . . 0.0 110.579 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.9 t -70.5 -24.51 62.86 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 122.364 -0.21 . . . . 0.0 111.029 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -71.68 -37.53 70.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.126 178.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.05 -38.63 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-N 118.401 0.546 . . . . 0.0 109.842 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -58.78 -37.86 77.26 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 110.508 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.7 m -78.05 -38.4 44.54 Favored 'General case' 0 N--CA 1.457 -0.085 0 O-C-N 122.432 -0.167 . . . . 0.0 110.656 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 60.3 mt -64.85 -33.35 75.79 Favored 'General case' 0 N--CA 1.456 -0.139 0 O-C-N 122.082 -0.386 . . . . 0.0 111.672 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.3 m -80.56 -28.68 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 CA-C-N 118.587 0.631 . . . . 0.0 110.521 177.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 89.5 m -68.58 -38.2 80.5 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -76.72 -27.62 55.51 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.267 -0.271 . . . . 0.0 110.888 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.67 -49.85 55.74 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 122.23 -0.294 . . . . 0.0 110.309 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.02 -22.34 62.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.716 -0.183 . . . . 0.0 111.131 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.91 -37.18 64.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.746 0.248 . . . . 0.0 110.726 177.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -74.45 -19.35 60.42 Favored 'General case' 0 N--CA 1.457 -0.079 0 CA-C-N 117.599 0.182 . . . . 0.0 110.544 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 19.2 mm -75.11 -56.39 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.79 -16.64 64.21 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -70.71 -22.29 62.46 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 179.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -157.57 -38.15 0.07 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -173.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 30.3 p 44.89 19.05 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.504 1.121 . . . . 0.0 112.274 -169.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -147.51 148.25 31.0 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.351 1.06 . . . . 0.0 109.636 -171.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -163.29 40.72 0.1 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.277 0.631 . . . . 0.0 110.038 179.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.2 22.47 7.85 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.893 0.877 . . . . 0.0 111.462 -172.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.69 156.97 46.97 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 122.967 0.507 . . . . 0.0 110.386 178.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -160.31 169.67 22.67 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.575 0.35 . . . . 0.0 111.081 -177.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 10.7 t 41.52 59.26 9.15 Favored Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 124.728 1.211 . . . . 0.0 112.014 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.52 166.04 28.65 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.383 2.722 . . . . 0.0 110.616 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -153.93 157.59 39.43 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 170.48 -174.79 44.47 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 79.8 p -149.29 21.19 0.95 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.135 0.574 . . . . 0.0 110.642 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 49.8 p-80 -139.7 11.03 2.47 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.414 0.686 . . . . 0.0 111.717 -174.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.28 12.23 1.96 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.915 0.486 . . . . 0.0 112.102 -179.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 55.8 t60 45.18 40.64 5.1 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.593 1.157 . . . . 0.0 113.115 175.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -55.72 163.4 1.39 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.766 0.427 . . . . 0.0 111.822 177.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -153.05 165.57 35.17 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 123.221 0.609 . . . . 0.0 109.518 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 28.8 p80 . . . . . 0 C--O 1.252 1.222 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.622 -179.332 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 110.27 -0.27 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 72.9 mt 52.76 22.98 2.51 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.148 0.979 . . . . 0.0 112.811 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -70.86 4.52 2.51 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.848 0.859 . . . . 0.0 111.969 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.23 156.23 54.23 Favored Pre-proline 0 CA--C 1.533 0.292 0 C-N-CA 123.615 0.766 . . . . 0.0 109.888 -176.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.52 153.1 49.5 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.324 2.683 . . . . 0.0 111.254 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 169.29 14.89 0.02 OUTLIER Glycine 0 CA--C 1.524 0.623 0 CA-C-O 119.625 -0.541 . . . . 0.0 112.969 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -148.6 176.07 10.65 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.102 0.951 . . . . 0.0 111.85 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -67.09 9.45 0.2 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.558 1.143 . . . . 0.0 113.715 -176.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -130.99 0.8 4.25 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.53 0.605 . . . . 0.0 111.633 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -140.98 3.77 1.83 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.196 0.599 . . . . 0.0 111.317 176.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -141.67 6.87 1.87 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.871 0.869 . . . . 0.0 110.363 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.0 -177.42 6.52 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.252 1.021 . . . . 0.0 109.275 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 50.5 m -133.87 -0.71 3.09 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 25.3 t -162.05 162.87 28.95 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.994 0.426 . . . . 0.0 110.488 177.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -152.93 7.17 0.4 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.374 1.07 . . . . 0.0 110.556 176.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -71.02 169.63 14.54 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.808 0.843 . . . . 0.0 111.295 -176.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 56.4 p -154.92 52.1 0.69 Allowed Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 123.183 0.593 . . . . 0.0 111.403 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -70.11 -0.17 6.8 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 123.551 2.834 . . . . 0.0 112.633 -177.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . 53.73 -166.93 0.07 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.144 0.978 . . . . 0.0 112.468 -178.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -145.88 147.16 31.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 2.2 t -144.15 5.41 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -169.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.11 17.11 2.27 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 -173.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 27.5 m -64.88 -0.24 1.44 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.908 0.483 . . . . 0.0 112.21 176.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -141.5 15.7 2.18 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.977 0.911 . . . . 0.0 111.097 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -73.1 10.45 0.94 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.793 0.837 . . . . 0.0 111.672 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -140.95 160.7 39.52 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.784 0.834 . . . . 0.0 110.338 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -66.22 -12.2 54.67 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.424 0.69 . . . . 0.0 112.58 -175.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -60.83 -27.0 67.75 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.302 0.501 . . . . 0.0 111.492 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.35 -33.69 61.32 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.669 -0.973 . . . . 0.0 110.669 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.49 -23.02 37.63 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 117.163 0.482 . . . . 0.0 110.841 179.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.05 -43.02 72.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.25 -39.34 75.05 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.112 177.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.93 -35.29 78.19 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.053 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.1 t -65.81 -42.94 90.05 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.477 0.581 . . . . 0.0 110.214 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.9 66.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.592 0.357 . . . . 0.0 111.81 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -110.77 -14.89 13.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 62.0 tp60 -68.33 -38.19 81.29 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.74 -24.99 67.74 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.211 0.078 . . . . 0.0 111.211 176.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 39.8 m -72.04 -12.59 61.29 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 47.0 pt -129.1 8.36 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 118.403 0.547 . . . . 0.0 111.92 -178.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.56 24.72 0.56 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.26 0.624 . . . . 0.0 111.536 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -144.77 -178.32 5.96 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.859 -0.526 . . . . 0.0 111.622 -176.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -61.91 175.96 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.583 1.153 . . . . 0.0 111.808 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.2 m -135.33 155.88 78.36 Favored Pre-proline 0 C--O 1.232 0.156 0 C-N-CA 122.924 0.49 . . . . 0.0 111.064 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.2 176.24 2.12 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.844 3.03 . . . . 0.0 112.472 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -148.55 -2.39 0.5 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.389 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -65.29 -24.85 67.41 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.681 0.393 . . . . 0.0 111.483 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 45.2 mtm -76.18 -36.7 58.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.403 0.281 . . . . 0.0 110.956 -179.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 64.2 mt -77.72 -15.58 59.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.616 -0.678 . . . . 0.0 109.736 175.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -71.11 -21.33 62.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.829 -0.545 . . . . 0.0 109.698 173.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.0 mt -71.56 -14.61 62.14 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 173.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.469 ' C ' ' H ' ' B' ' 54' ' ' LYS . 28.5 mt -89.73 -16.47 30.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.747 0.249 . . . . 0.0 111.48 174.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -71.09 18.35 0.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.469 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.8 pttt -133.91 2.7 3.41 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.31 0.644 . . . . 0.0 111.918 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -153.04 -3.3 0.22 Allowed 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -132.84 0.26 3.51 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.751 0.705 . . . . 0.0 112.096 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 49.9 tp -77.6 153.34 33.34 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -144.67 169.37 18.12 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 123.364 0.666 . . . . 0.0 110.184 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.4 tp -67.27 -11.72 58.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.061 0.544 . . . . 0.0 111.677 -178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 13.1 p -150.43 139.39 13.03 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -73.47 178.31 6.84 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.666 2.911 . . . . 0.0 111.194 177.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 . . . . . 0 C--N 1.337 0.06 0 C-N-CA 123.245 0.618 . . . . 0.0 109.888 179.802 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.0 ttm . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 110.63 -0.137 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.2 p -145.52 -11.89 0.52 Allowed 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 122.798 0.439 . . . . 0.0 111.7 176.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.1 tp -85.27 -31.73 22.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 117.997 0.362 . . . . 0.0 111.04 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.83 -30.62 74.54 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -73.11 2.18 7.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.903 0.881 . . . . 0.0 111.269 177.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -130.66 -20.37 2.9 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.461 0.704 . . . . 0.0 111.043 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.53 -32.51 18.15 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.568 0.347 . . . . 0.0 111.313 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.413 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.79 -44.28 96.83 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 72.2 Cg_endo -71.89 -2.32 11.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.098 1.866 . . . . 0.0 112.423 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -135.2 12.73 3.56 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.122 0.569 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 tp -57.82 -41.94 92.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.835 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -76.67 -10.94 18.61 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.592 1.528 . . . . 0.0 112.275 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -70.78 -21.28 62.52 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-N 118.775 0.716 . . . . 0.0 110.814 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.4 mt -70.79 -28.18 64.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.831 0.287 . . . . 0.0 110.984 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ptm85 -105.04 -13.67 15.67 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 122.243 -0.286 . . . . 0.0 110.728 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -52.68 -25.81 12.02 Favored 'General case' 0 C--N 1.338 0.071 0 C-N-CA 123.911 0.884 . . . . 0.0 110.845 175.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -139.99 -10.1 1.15 Allowed 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 123.102 0.251 . . . . 0.0 111.576 175.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.0 -28.47 63.73 Favored Glycine 0 C--N 1.34 0.76 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 173.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.34 -8.4 39.61 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.199 0.6 . . . . 0.0 111.837 175.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -116.73 0.37 12.56 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.103 0.561 . . . . 0.0 111.622 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -97.61 -3.53 39.36 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.062 0.545 . . . . 0.0 111.379 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -156.59 -5.65 0.11 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.58 26.06 51.77 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 121.891 -0.506 . . . . 0.0 113.778 174.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 t -150.92 127.45 10.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.798 0.799 . . . . 0.0 109.553 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -71.82 -18.66 62.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.112 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -68.32 -42.67 79.04 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -81.17 -31.72 33.92 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 177.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.52 -42.54 93.57 Favored Glycine 0 C--N 1.335 0.515 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -72.51 -30.23 64.3 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 117.595 0.697 . . . . 0.0 110.148 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -71.09 -41.82 70.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.411 -0.328 . . . . 0.0 111.487 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -66.07 -44.21 85.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.412 0.551 . . . . 0.0 111.598 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.7 m -68.52 -34.72 66.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 CA-C-N 118.499 0.59 . . . . 0.0 110.97 -176.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.9 ttp180 -79.45 -32.45 42.68 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.094 -0.379 . . . . 0.0 110.825 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.61 63.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 64.5 m -64.61 -40.38 95.39 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.62 -34.98 53.16 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -61.67 -24.27 66.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.96 -0.462 . . . . 0.0 110.411 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.15 -16.17 59.24 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.593 0.357 . . . . 0.0 111.04 175.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 20.3 mm -90.57 -18.92 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 58.7 t -64.52 -4.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.277 0.631 . . . . 0.0 110.968 176.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.47 1.68 9.57 Favored 'General case' 0 C--N 1.34 0.177 0 O-C-N 121.697 -0.627 . . . . 0.0 111.195 178.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -158.16 54.35 0.74 Allowed Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 123.239 0.616 . . . . 0.0 111.094 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -72.08 -3.71 13.79 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.981 3.121 . . . . 0.0 112.034 -176.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -106.01 12.59 30.3 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.268 0.627 . . . . 0.0 112.131 -175.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -138.67 7.92 2.56 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -56.15 132.13 74.88 Favored Pre-proline 0 CA--C 1.531 0.237 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -69.97 120.94 7.6 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.346 2.697 . . . . 0.0 112.038 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.4 mmm180 -142.14 6.17 1.73 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.96 1.304 . . . . 0.0 110.205 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -82.53 13.3 3.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.117 0.967 . . . . 0.0 111.068 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.65 -166.73 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 125.03 1.332 . . . . 0.0 108.654 -177.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.54 144.09 18.35 Favored Pre-proline 0 N--CA 1.455 -0.195 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -65.87 2.02 1.96 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.899 2.399 . . . . 0.0 112.259 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -121.64 -18.35 7.19 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 123.616 0.766 . . . . 0.0 111.162 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -74.34 -31.21 62.34 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.262 0.483 . . . . 0.0 110.325 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.46 -33.99 68.05 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.74 -44.54 95.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -80.5 -19.87 44.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.315 -0.374 . . . . 0.0 111.782 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 24.3 tpt180 -70.48 -47.31 61.17 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.643 0.656 . . . . 0.0 110.548 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -71.34 -33.7 69.84 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.098 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -66.72 -39.85 88.16 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.288 -0.258 . . . . 0.0 111.314 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -68.41 -24.72 64.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.75 -37.57 84.48 Favored Glycine 0 C--N 1.339 0.717 0 N-CA-C 111.394 -0.683 . . . . 0.0 111.394 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.2 mm -73.48 -41.6 56.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.127 0 CA-C-N 117.84 0.82 . . . . 0.0 110.166 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.4 t90 -67.54 -38.17 83.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.713 0.233 . . . . 0.0 110.934 -176.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.05 -29.0 62.65 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.241 -0.287 . . . . 0.0 111.108 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 40.2 t -80.08 -30.68 39.27 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 117.539 0.154 . . . . 0.0 110.938 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.77 -31.0 59.33 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.411 -0.181 . . . . 0.0 111.182 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -85.33 -12.45 52.23 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 122.172 -0.33 . . . . 0.0 111.335 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.23 0.03 26.74 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -140.34 4.51 2.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.665 0.386 . . . . 0.0 111.362 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.13 6.21 88.33 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.941 -0.366 . . . . 0.0 112.809 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -75.59 5.14 6.41 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 117.664 0.732 . . . . 0.0 111.807 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -150.78 172.2 15.98 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.077 0.465 . . . . 0.0 111.131 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -146.66 -167.13 2.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.06 1.344 . . . . 0.0 108.729 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 10.4 t -138.9 164.17 30.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.993 0.517 . . . . 0.0 110.03 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.0 t -158.43 -172.72 3.97 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.398 0.679 . . . . 0.0 109.774 -176.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -148.58 8.55 0.79 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.5 m -146.14 142.13 28.18 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.896 0.771 . . . . 0.0 111.499 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -154.13 10.91 0.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.313 1.045 . . . . 0.0 110.403 175.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -153.81 -174.89 5.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.622 0.769 . . . . 0.0 109.582 -176.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -126.17 11.25 7.56 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.106 0.562 . . . . 0.0 110.764 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -166.18 9.71 0.06 OUTLIER Glycine 0 CA--C 1.527 0.843 0 CA-C-O 119.23 -0.761 . . . . 0.0 112.653 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.2 p -139.68 -7.58 1.27 Allowed 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.567 1.184 . . . . 0.0 112.917 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -137.93 -39.18 0.56 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.75 -25.41 67.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.9 p -66.66 -31.02 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 C-N-CA 122.542 0.337 . . . . 0.0 110.565 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.2 -1.08 52.13 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.223 0.609 . . . . 0.0 111.568 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -130.55 -15.07 3.61 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.49 0.316 . . . . 0.0 111.698 177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.92 -1.93 18.84 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.871 0.468 . . . . 0.0 110.468 174.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -129.25 -15.64 4.11 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.994 0.518 . . . . 0.0 111.536 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.443 ' C ' ' H ' ' A' ' 93' ' ' ARG . 3.5 mm? -138.02 36.44 2.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.114 0.966 . . . . 0.0 110.59 -172.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.88 7.77 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.443 ' H ' ' C ' ' A' ' 91' ' ' LEU . 82.3 mmt-85 -130.68 4.35 4.59 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.062 0.846 . . . . 0.0 112.361 -177.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 57.2 ttm -65.79 143.69 57.34 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.369 0.531 . . . . 0.0 111.168 -178.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 m -61.37 139.12 94.82 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.926 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -66.62 5.45 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 124.246 3.297 . . . . 0.0 113.564 -177.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.97 -35.03 2.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.5 m -62.42 -19.65 63.69 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.0 -0.437 . . . . 0.0 109.86 171.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -58.26 -41.34 84.06 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.664 0.786 . . . . 0.0 110.72 174.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -77.47 -38.49 49.17 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.73 74.43 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 122.243 -0.286 . . . . 0.0 110.825 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -66.56 -48.65 68.97 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.3 mt -67.93 -14.95 63.37 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.882 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.0 mt -98.72 -4.82 32.73 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.911 0.484 . . . . 0.0 111.909 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -136.27 10.24 3.24 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.99 4.94 2.31 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.9 mtm -140.8 -5.02 1.18 Allowed 'General case' 0 C--N 1.339 0.109 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -150.25 -5.88 0.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.382 0.992 . . . . 0.0 112.987 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.95 25.25 65.77 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-O 119.009 -0.884 . . . . 0.0 113.828 175.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -55.38 150.16 11.99 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.641 1.22 . . . . 0.0 110.08 177.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 69.7 m -68.39 153.26 95.86 Favored Pre-proline 0 CA--C 1.529 0.172 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.78 -28.62 39.09 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 123.188 2.592 . . . . 0.0 112.807 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -72.84 -32.82 65.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.23 -0.293 . . . . 0.0 110.772 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -83.52 -36.01 24.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 122.367 -0.208 . . . . 0.0 110.499 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.02 70.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 122.396 -0.19 . . . . 0.0 110.99 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.55 -28.58 33.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.66 0.384 . . . . 0.0 111.252 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -71.34 -27.62 63.5 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.651 0.78 . . . . 0.0 111.59 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.9 mt -85.78 -0.16 54.53 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 20.0 pt -135.42 9.86 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 118.509 0.595 . . . . 0.0 111.575 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 55.34 53.92 9.31 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.498 1.119 . . . . 0.0 113.87 175.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 23.3 m -134.79 174.94 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 C-N-CA 122.895 0.478 . . . . 0.0 110.023 174.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -76.29 158.37 31.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 37.2 m -59.87 -36.61 77.28 Favored 'General case' 0 C--N 1.334 -0.098 0 O-C-N 122.109 -0.37 . . . . 0.0 111.149 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 93.4 p -76.88 -20.92 55.7 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 121.79 -0.569 . . . . 0.0 111.1 -178.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.0 -44.02 55.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.059 178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.07 -31.23 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.238 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -62.4 -35.32 78.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.707 0.23 . . . . 0.0 110.408 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.6 m -75.63 -36.65 60.16 Favored 'General case' 0 N--CA 1.457 -0.097 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 178.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.1 mp -67.37 -36.58 81.65 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 119.263 -0.399 . . . . 0.0 111.191 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.9 m -76.47 -26.09 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.128 0 CA-C-N 118.937 0.789 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 82.5 m -66.59 -35.79 81.06 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -80.85 -26.77 36.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.364 -0.21 . . . . 0.0 110.623 177.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.53 73.1 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.43 -0.169 . . . . 0.0 110.63 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -78.18 -22.33 48.78 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.916 -0.49 . . . . 0.0 110.333 177.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.82 -38.71 70.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.214 -0.304 . . . . 0.0 110.466 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -78.85 -18.83 53.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.349 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 5.6 mm -63.68 -51.16 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.12 -17.04 61.44 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -71.89 -17.67 62.1 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.428 ' C ' ' H ' ' A' ' 142' ' ' ARG . 19.9 pt20 -149.82 -41.98 0.14 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.0 p 45.81 -7.49 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 117.367 2.358 . . . . 0.0 117.367 -175.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.428 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.0 OUTLIER -160.08 2.73 0.08 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 120.14 1.337 . . . . 0.0 114.386 -177.13 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -71.99 155.5 40.27 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 118.774 0.715 . . . . 0.0 110.671 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.56 6.55 0.47 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.814 0.446 . . . . 0.0 111.766 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -147.61 17.32 1.15 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.739 0.415 . . . . 0.0 110.192 -177.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 48.9 tp -59.23 154.4 16.41 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.692 0.797 . . . . 0.0 111.251 -178.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.44 HG13 ' H ' ' A' ' 149' ' ' ARG . 45.9 t -142.84 136.03 13.99 Favored Pre-proline 0 N--CA 1.455 -0.176 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.52 0.15 7.33 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.861 3.041 . . . . 0.0 113.236 -177.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . 0.44 ' H ' HG13 ' A' ' 147' ' ' VAL . 61.9 ttt-85 45.69 35.09 1.99 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.462 1.105 . . . . 0.0 111.851 -177.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -77.16 3.52 57.72 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 123.534 0.588 . . . . 0.0 112.367 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 82.5 p -150.72 171.3 17.38 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.699 0.75 . . . . 0.0 110.48 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -152.62 168.54 25.28 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 123.391 0.677 . . . . 0.0 109.691 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -143.19 8.83 1.64 Allowed 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.921 0.488 . . . . 0.0 111.369 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 53.7 m80 56.52 6.8 0.3 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.915 1.286 . . . . 0.0 113.253 -177.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -159.53 148.57 18.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.716 0.806 . . . . 0.0 109.205 177.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -150.99 168.09 25.62 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.553 0.741 . . . . 0.0 109.83 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 44.9 p-80 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.082 -1.437 . . . . 0.0 110.565 -179.011 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 120.659 0.266 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 42.0 tp -151.05 158.41 44.05 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -70.13 -9.62 56.18 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 66.7 mt -147.95 159.11 41.11 Favored Pre-proline 0 C--O 1.233 0.218 0 C-N-CA 124.093 0.957 . . . . 0.0 109.294 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.22 163.37 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 123.915 3.077 . . . . 0.0 112.547 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.98 171.17 42.57 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 178.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 45.9 t30 54.97 179.8 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.598 1.159 . . . . 0.0 111.817 -176.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 64.0 mttp 46.92 32.61 1.9 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.086 0.954 . . . . 0.0 112.571 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -140.8 16.69 2.32 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.02 0.528 . . . . 0.0 110.836 -177.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -60.22 -11.33 6.03 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.127 0.571 . . . . 0.0 112.539 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -66.49 -20.28 66.0 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.333 0.653 . . . . 0.0 111.051 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . 52.82 -173.77 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.67 1.188 . . . . 0.0 112.809 -176.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 79.4 p -148.03 5.95 0.77 Allowed 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 122.613 0.365 . . . . 0.0 111.836 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 29.0 m -65.32 163.97 14.45 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.021 0.528 . . . . 0.0 111.272 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -65.37 151.81 45.37 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.852 0.461 . . . . 0.0 110.109 178.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -144.37 169.22 18.34 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.949 0.9 . . . . 0.0 109.791 -179.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 49.6 m -64.13 161.92 35.97 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.172 0.589 . . . . 0.0 110.967 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -52.17 166.34 0.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.242 3.295 . . . . 0.0 113.118 174.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.24 70.88 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.72 0.408 . . . . 0.0 111.402 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 20.1 tptm 36.81 55.97 1.18 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 125.439 1.496 . . . . 0.0 112.717 -179.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 33.6 m -60.17 176.38 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 123.749 0.82 . . . . 0.0 111.903 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -141.11 10.54 2.15 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.519 0.728 . . . . 0.0 111.316 -177.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 48.5 m -145.03 166.27 25.82 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 123.205 0.602 . . . . 0.0 110.135 -177.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -143.17 10.91 1.74 Allowed 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 122.993 0.517 . . . . 0.0 111.482 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -62.86 -8.18 6.49 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.941 0.496 . . . . 0.0 111.961 -178.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -67.88 -8.06 33.42 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 123.154 0.581 . . . . 0.0 111.956 178.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -64.01 -9.44 15.97 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.3 tpt -62.14 -28.7 69.83 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.108 0.413 . . . . 0.0 110.359 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.98 62.89 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -17.44 62.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.157 0.479 . . . . 0.0 111.103 178.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.98 -41.69 20.4 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 20.0 mt -70.82 -37.76 73.24 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.64 -29.14 69.1 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.357 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t -67.29 -40.39 86.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.746 0.703 . . . . 0.0 110.277 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.75 -24.23 64.42 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -105.55 -12.49 15.94 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -72.38 -37.99 68.59 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -65.33 -21.86 66.75 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.804 -0.141 . . . . 0.0 110.789 177.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 60.8 m -73.89 -13.23 60.88 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 117.628 0.195 . . . . 0.0 111.282 174.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 63.6 mt -98.26 -23.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 O-C-N 121.933 -0.479 . . . . 0.0 109.934 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.78 27.2 0.18 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.757 0.823 . . . . 0.0 112.103 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -139.57 175.9 9.18 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -64.68 177.62 0.9 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.193 0.997 . . . . 0.0 112.023 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.11 154.28 77.32 Favored Pre-proline 0 C--O 1.233 0.23 0 C-N-CA 123.774 0.829 . . . . 0.0 109.794 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . 0.408 ' C ' ' H ' ' B' ' 47' ' ' GLU . 91.2 Cg_endo -76.25 -26.59 8.85 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.912 2.408 . . . . 0.0 113.341 -175.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p30 45.15 0.98 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.254 2.222 . . . . 0.0 116.599 -177.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.408 ' H ' ' C ' ' B' ' 45' ' ' PRO . 13.7 pt-20 -66.78 -17.06 64.68 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.243 0.929 . . . . 0.0 111.534 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 17.9 mtm -68.33 -42.03 79.93 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.87 -16.32 57.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -67.71 -21.79 65.29 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.834 -0.541 . . . . 0.0 109.819 173.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.73 -28.86 65.04 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 173.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.96 -14.33 60.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 121.266 -0.174 . . . . 0.0 111.442 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -67.68 -1.05 4.6 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.123 0.42 . . . . 0.0 110.34 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -96.27 -10.15 28.61 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.207 0.603 . . . . 0.0 112.164 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -156.28 -1.1 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.12 8.74 2.73 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 119.062 0.846 . . . . 0.0 112.74 -178.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.91 169.38 20.69 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.238 0.472 . . . . 0.0 110.536 178.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -144.6 179.51 7.24 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.3 1.04 . . . . 0.0 109.645 -178.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -60.64 163.76 5.19 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.271 0.557 . . . . 0.0 111.556 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.5 p -58.75 136.38 86.76 Favored Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.515 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -73.33 171.08 18.39 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.606 2.871 . . . . 0.0 111.189 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 53.7 ptt85 . . . . . 0 CA--C 1.527 0.083 0 C-N-CA 123.507 0.723 . . . . 0.0 110.78 179.93 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.476 0.843 0 CA-C-O 119.458 -0.306 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 t -157.14 -2.9 0.11 Allowed 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.51 -37.49 85.16 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.389 -0.819 . . . . 0.0 110.817 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.19 -28.24 71.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -77.94 1.49 20.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.414 0.686 . . . . 0.0 111.443 179.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -130.2 -3.66 4.43 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.235 0.614 . . . . 0.0 111.71 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.4 mt -111.19 -25.71 9.57 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.519 -0.277 . . . . 0.0 111.157 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.0 -43.96 76.65 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -74.4 -1.37 10.92 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.52 2.147 . . . . 0.0 113.156 -175.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -134.99 12.26 3.61 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.929 0.492 . . . . 0.0 110.637 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.418 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 43.1 tp -64.47 -39.54 42.36 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 124.847 1.259 . . . . 0.0 114.207 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 90.6 Cg_endo -77.9 -26.22 6.9 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 CA-C-N 120.666 1.274 . . . . 0.0 112.436 -172.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -51.52 -38.34 53.69 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.606 0.639 . . . . 0.0 111.981 -173.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.7 mt -67.54 -19.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -112.56 -32.55 6.43 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -73.98 -6.96 50.53 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.268 0.227 . . . . 0.0 111.235 -177.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -136.8 -13.35 1.69 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.728 0.411 . . . . 0.0 110.785 167.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -57.45 -33.57 66.61 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -59.86 -24.2 64.04 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 117.931 0.865 . . . . 0.0 111.848 177.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.76 0.94 57.46 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.254 0.622 . . . . 0.0 110.654 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -120.86 4.83 10.49 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.508 1.123 . . . . 0.0 110.474 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.9 p -139.22 -15.04 1.12 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.65 -2.99 87.64 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.456 -0.635 . . . . 0.0 113.146 177.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.6 t -159.95 136.06 8.71 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.243 1.022 . . . . 0.0 111.099 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -66.2 -19.09 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.37 -0.206 . . . . 0.0 111.344 175.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -75.34 -28.31 59.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 117.92 0.327 . . . . 0.0 110.198 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -78.11 -37.25 46.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.21 -29.99 75.05 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -69.55 -41.74 75.5 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.244 0.522 . . . . 0.0 110.887 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.29 -24.03 27.89 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 118.906 -0.569 . . . . 0.0 112.27 -175.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -72.77 -36.34 67.63 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 119.309 0.959 . . . . 0.0 109.925 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.6 t -64.89 -43.17 96.33 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 CA-C-N 117.856 0.298 . . . . 0.0 110.618 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -77.31 -28.39 53.22 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 121.279 -0.169 . . . . 0.0 111.266 -178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.48 -27.68 58.92 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.228 0.211 . . . . 0.0 110.589 175.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 53.0 m -63.95 -39.24 93.69 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.73 -45.9 56.32 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -58.31 -30.25 66.53 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.79 0.436 . . . . 0.0 111.773 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.56 0.45 22.96 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.794 0.438 . . . . 0.0 111.918 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 73.1 mt -124.72 -13.9 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 C-N-CA 123.909 0.884 . . . . 0.0 110.177 -177.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.0 t -61.48 -14.45 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.312 0.645 . . . . 0.0 111.09 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.76 5.6 9.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.582 0.753 . . . . 0.0 110.562 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.83 51.75 0.77 Allowed Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 123.335 0.654 . . . . 0.0 111.51 -175.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.46 -8.01 19.5 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.176 2.584 . . . . 0.0 111.856 -178.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -82.1 3.37 27.22 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.956 0.902 . . . . 0.0 110.734 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -114.29 9.07 16.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.052 0.541 . . . . 0.0 111.316 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -129.59 64.5 71.86 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 122.285 0.234 . . . . 0.0 110.489 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.91 170.5 15.4 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.923 3.082 . . . . 0.0 111.334 -178.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.462 ' C ' ' H ' ' A' ' 50' ' ' VAL . 31.1 mmm180 -125.62 12.8 8.04 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.934 0.894 . . . . 0.0 110.589 -177.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -73.35 18.78 0.11 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.47 1.108 . . . . 0.0 111.337 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.462 ' H ' ' C ' ' A' ' 48' ' ' ARG . 27.8 m -136.73 178.6 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 124.7 1.2 . . . . 0.0 109.511 -176.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -54.55 149.4 21.32 Favored Pre-proline 0 C--O 1.233 0.209 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.3 5.93 1.7 Allowed 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.144 2.562 . . . . 0.0 111.953 -176.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -128.16 -24.06 3.2 Favored 'General case' 0 C--O 1.228 -0.033 0 C-N-CA 123.764 0.825 . . . . 0.0 111.35 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.9 tp -66.99 -32.41 73.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.333 0.515 . . . . 0.0 110.287 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -72.91 -34.78 58.69 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.51 -43.22 90.78 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -73.97 -34.5 64.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.475 0.176 . . . . 0.0 111.475 -177.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 48.3 tpt85 -72.47 -37.43 68.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -174.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.0 mmm -76.8 -31.98 57.34 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.18 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -67.09 -35.03 78.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 174.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -64.46 -31.03 72.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.531 0.332 . . . . 0.0 110.236 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.02 -43.84 90.0 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.6 mm -72.98 -39.07 57.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 117.353 0.577 . . . . 0.0 110.099 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -68.25 -41.65 80.83 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.41 -0.181 . . . . 0.0 111.132 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.91 -32.64 74.03 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.186 0.448 . . . . 0.0 110.648 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.1 t -70.12 -25.94 63.72 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 117.515 0.143 . . . . 0.0 110.663 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.59 -36.02 17.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.493 0.317 . . . . 0.0 111.668 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.5 -15.81 61.79 Favored 'General case' 0 C--O 1.226 -0.14 0 O-C-N 121.973 -0.454 . . . . 0.0 110.522 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.96 7.6 8.64 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 111.471 177.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -130.79 -5.24 4.05 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.45 -9.9 3.49 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 114.747 0.659 . . . . 0.0 114.747 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -72.84 6.3 2.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.369 1.084 . . . . 0.0 112.489 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.1 24.0 0.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.516 1.126 . . . . 0.0 112.749 -174.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -154.1 168.61 25.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.253 0.621 . . . . 0.0 110.392 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.7 t 43.58 39.83 2.55 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.269 1.427 . . . . 0.0 112.47 -179.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.1 p -132.17 9.52 4.45 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.44 -14.47 61.26 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 85.8 p -163.72 166.32 22.26 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.798 -0.564 . . . . 0.0 111.969 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -146.1 23.19 1.36 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.091 0.957 . . . . 0.0 110.547 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -142.96 -179.35 6.31 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.109 0.564 . . . . 0.0 110.504 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -136.92 14.76 3.09 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.941 0.497 . . . . 0.0 111.51 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.44 -0.61 0.23 Allowed Glycine 0 CA--C 1.527 0.832 0 CA-C-O 119.516 -0.602 . . . . 0.0 114.061 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -152.2 8.56 0.48 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.386 1.093 . . . . 0.0 112.198 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -139.01 -28.98 0.78 Allowed 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.067 0.547 . . . . 0.0 109.99 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.29 67.69 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 174.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 10.5 p -67.03 -28.87 44.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-O 120.696 0.284 . . . . 0.0 110.318 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 0.74 51.78 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.34 0.656 . . . . 0.0 111.89 -177.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.89 -17.83 3.1 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-N 118.121 0.419 . . . . 0.0 111.815 176.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.14 -1.79 24.75 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.586 0.355 . . . . 0.0 110.679 174.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -128.58 -12.22 4.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.621 0.768 . . . . 0.0 111.564 -179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' A' ' 93' ' ' ARG . 10.0 mp -131.15 24.11 4.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.5 1.12 . . . . 0.0 109.856 -174.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.0 7.26 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.384 1.474 . . . . 0.0 114.826 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.418 ' H ' ' C ' ' A' ' 91' ' ' LEU . 17.7 tpt180 -130.32 -0.15 4.55 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.879 0.763 . . . . 0.0 111.677 -177.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.3 ttm -67.09 147.67 52.86 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 122.079 -0.388 . . . . 0.0 110.514 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.1 m -65.85 140.74 97.36 Favored Pre-proline 0 CA--C 1.531 0.236 0 C-N-CA 123.444 0.698 . . . . 0.0 110.594 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -53.63 2.89 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.474 1 C-N-CA 125.475 4.117 . . . . 0.0 116.313 177.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.2 tp -133.18 -20.03 2.17 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 119.056 0.844 . . . . 0.0 111.586 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.9 m -70.2 -19.4 63.17 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 122.051 -0.405 . . . . 0.0 110.919 176.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -65.47 -45.21 84.59 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.437 0.295 . . . . 0.0 110.973 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -83.26 -25.8 31.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.991 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.62 79.42 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.366 0.53 . . . . 0.0 109.785 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 tp -67.74 -37.59 82.38 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.994 0.518 . . . . 0.0 109.91 177.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.424 ' HA ' ' HE3' ' A' ' 107' ' ' MET . 57.3 tp -66.27 -21.34 66.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 122.562 0.345 . . . . 0.0 110.729 177.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.413 ' CD1' ' HB2' ' A' ' 110' ' ' PHE . 0.2 OUTLIER -90.96 -14.98 30.52 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.207 0.603 . . . . 0.0 111.778 -177.38 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.9 p -134.49 4.86 3.42 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -173.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -123.68 -6.98 7.99 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 118.532 0.605 . . . . 0.0 110.771 174.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.424 ' HE3' ' HA ' ' A' ' 103' ' ' LEU . 21.7 mtm -143.25 0.6 1.18 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -175.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -135.48 -19.96 1.62 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.157 0.435 . . . . 0.0 111.786 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 59.97 17.41 43.8 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 119.118 -0.823 . . . . 0.0 114.501 172.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . 0.413 ' HB2' ' CD1' ' A' ' 104' ' ' LEU . 16.7 m-30 -68.67 162.32 26.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.119 1.46 . . . . 0.0 109.716 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 41.4 t -66.1 145.91 99.01 Favored Pre-proline 0 N--CA 1.456 -0.155 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 175.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.27 -20.39 14.76 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 122.893 2.395 . . . . 0.0 112.656 174.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.2 -31.13 65.6 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 122.44 0.296 . . . . 0.0 111.05 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -80.78 -36.31 31.98 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -66.23 -32.93 74.65 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.662 0.385 . . . . 0.0 110.517 175.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -72.46 -32.45 66.27 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 122.33 0.252 . . . . 0.0 110.823 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -73.76 -22.9 59.7 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 110.758 176.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 28.2 tp -84.26 -9.95 58.07 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -177.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.7 pt -135.25 11.75 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.386 0.539 . . . . 0.0 111.351 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 53.52 59.56 4.27 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.65 1.18 . . . . 0.0 113.96 176.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.4 m -137.77 -179.83 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 C-N-CA 123.683 0.793 . . . . 0.0 109.67 175.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -79.58 156.31 27.76 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.5 m -59.17 -37.27 76.96 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 122.141 -0.349 . . . . 0.0 110.77 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.3 t -72.58 -24.49 61.11 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.316 0.247 . . . . 0.0 111.38 -177.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -69.45 -39.76 77.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.726 -0.609 . . . . 0.0 109.794 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.1 t -64.25 -40.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.107 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -58.73 -37.13 75.51 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 122.929 0.143 . . . . 0.0 110.618 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.9 m -77.86 -38.79 45.28 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.2 mt -64.85 -36.06 83.12 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -177.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 32.2 m -82.86 -28.92 8.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.111 0 CA-C-N 118.343 0.52 . . . . 0.0 111.184 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 54.6 m -68.76 -38.98 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 117.843 0.292 . . . . 0.0 110.224 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -75.79 -27.63 58.05 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.597 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.57 -52.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.356 -0.215 . . . . 0.0 110.88 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -71.19 -22.35 62.04 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.41 78.63 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 175.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -74.94 -18.65 60.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.57 -0.252 . . . . 0.0 110.837 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 21.9 mm -74.93 -55.54 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 CA-C-N 118.371 0.532 . . . . 0.0 109.902 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -19.68 65.79 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.071 0.396 . . . . 0.0 111.793 -176.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.5 -22.07 62.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . 0.449 ' HG3' ' H ' ' A' ' 142' ' ' ARG . 11.0 pt20 -162.98 -32.32 0.04 OUTLIER 'General case' 0 C--N 1.34 0.192 0 N-CA-C 115.278 1.585 . . . . 0.0 115.278 -170.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.5 p 44.77 25.04 0.12 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.968 0.907 . . . . 0.0 112.163 -170.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.449 ' H ' ' HG3' ' A' ' 140' ' ' GLN . 73.0 mtt85 -149.02 20.13 0.98 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.381 1.473 . . . . 0.0 110.317 -171.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.44 143.02 25.16 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.26 1.024 . . . . 0.0 113.169 -171.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -157.02 -6.12 0.1 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.851 176.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -158.22 148.69 20.37 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.146 0.578 . . . . 0.0 109.493 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 46.1 tp -163.27 162.54 25.29 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.973 0.909 . . . . 0.0 108.988 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 24.8 m -136.69 146.96 57.59 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 123.025 0.53 . . . . 0.0 110.017 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -80.62 5.66 5.98 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 125.072 3.848 . . . . 0.0 113.408 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -140.48 162.05 36.27 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.885 0.766 . . . . 0.0 111.566 -172.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -165.38 -172.1 32.39 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 -179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 20.1 t -147.94 171.61 15.51 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 117.407 0.603 . . . . 0.0 110.81 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -156.67 159.45 38.42 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.241 0.617 . . . . 0.0 110.114 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 54.8 p-80 -156.14 172.67 18.04 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.319 0.647 . . . . 0.0 110.107 178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 -146.53 -15.08 0.44 Allowed 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -159.8 166.69 29.86 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.868 0.467 . . . . 0.0 110.425 178.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -152.68 0.61 0.29 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.098 0.559 . . . . 0.0 111.052 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 . . . . . 0 C--O 1.251 1.153 0 C-N-CA 125.055 1.342 . . . . 0.0 111.91 -178.212 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ptp . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 18.4 tp 51.44 32.14 8.28 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.799 0.84 . . . . 0.0 111.459 -177.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -145.5 172.58 13.01 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.67 0.788 . . . . 0.0 110.789 -179.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.56 128.42 86.13 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 122.801 0.441 . . . . 0.0 109.844 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -74.5 166.79 28.63 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 123.044 2.496 . . . . 0.0 111.197 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 175.23 170.44 38.2 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 178.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -159.5 165.63 32.6 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.724 0.41 . . . . 0.0 110.343 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -153.3 154.81 35.32 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.044 0.938 . . . . 0.0 109.18 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -153.66 -179.24 7.62 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.992 0.517 . . . . 0.0 110.779 -176.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -148.19 178.13 8.82 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.633 0.773 . . . . 0.0 109.479 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 13.9 tppt? -140.78 17.15 2.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.596 0.358 . . . . 0.0 111.367 -176.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.5 171.18 15.94 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.857 0.36 . . . . 0.0 110.887 -179.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 80.4 p -156.75 173.97 16.18 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.006 0.922 . . . . 0.0 109.98 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 88.0 p -67.1 165.7 15.36 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 122.629 0.372 . . . . 0.0 111.262 178.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -72.74 -2.01 18.69 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.335 0.654 . . . . 0.0 112.113 176.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 52.79 -170.27 0.04 OUTLIER 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.504 1.122 . . . . 0.0 112.477 -177.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 41.9 m 44.21 54.16 11.57 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.414 1.085 . . . . 0.0 113.391 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.86 166.29 29.44 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.339 2.693 . . . . 0.0 110.563 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -155.6 169.0 25.33 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.607 0.363 . . . . 0.0 111.001 -179.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.9 14.22 0.92 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.903 0.881 . . . . 0.0 111.305 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 32.1 m -141.31 -174.25 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 124.235 1.014 . . . . 0.0 109.886 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.51 171.79 13.85 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.488 0.715 . . . . 0.0 110.691 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 11.2 t -154.77 -170.06 3.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.003 0.521 . . . . 0.0 110.114 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -134.42 174.98 9.94 Favored 'General case' 0 C--O 1.23 0.062 0 C-N-CA 123.93 0.892 . . . . 0.0 109.732 -178.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -61.03 -22.84 64.95 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.987 -178.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 53.1 ptt85 47.0 -33.18 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 130.563 3.545 . . . . 0.0 118.315 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -152.6 -16.41 0.17 Allowed 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 120.053 1.297 . . . . 0.0 111.46 -178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -66.41 -29.02 69.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.384 0.538 . . . . 0.0 111.207 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.51 -34.74 79.83 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.89 -21.57 65.14 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 122.297 -0.531 . . . . 0.0 110.939 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.88 -36.29 21.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.92 0.391 . . . . 0.0 110.322 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -72.99 -45.82 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.869 0.468 . . . . 0.0 110.733 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.1 tpp85 -73.0 -27.4 61.76 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.002 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 46.8 t -66.52 -36.14 81.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.692 0.678 . . . . 0.0 110.311 177.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.26 -30.05 66.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.125 0.17 . . . . 0.0 110.965 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -91.29 -25.45 19.44 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 122.045 -0.41 . . . . 0.0 111.686 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -69.19 -37.47 78.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.668 0.667 . . . . 0.0 110.988 -178.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -63.22 -20.19 65.21 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 118.213 0.461 . . . . 0.0 110.677 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 9.4 m -86.72 -3.26 59.03 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.652 0.781 . . . . 0.0 111.207 175.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.445 ' C ' ' H ' ' B' ' 42' ' ' GLU . 81.4 mt -119.9 -8.5 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.619 -0.676 . . . . 0.0 111.366 -175.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -70.32 28.38 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.875 0.87 . . . . 0.0 112.122 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.445 ' H ' ' C ' ' B' ' 40' ' ' ILE . 12.8 pt-20 -142.1 179.2 7.04 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.571 -0.706 . . . . 0.0 111.371 -178.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -59.53 178.02 0.17 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.428 1.091 . . . . 0.0 113.543 -176.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -133.7 158.47 75.44 Favored Pre-proline 0 C--O 1.234 0.244 0 C-N-CA 124.175 0.99 . . . . 0.0 109.725 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -75.11 -179.82 5.39 Favored 'Trans proline' 0 N--CA 1.451 -1.018 0 C-N-CA 122.818 2.345 . . . . 0.0 110.357 176.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -148.43 -2.34 0.51 Allowed 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 177.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -66.15 -21.69 66.34 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 121.69 -0.631 . . . . 0.0 111.945 -177.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -67.09 -45.61 76.76 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.98 -20.25 58.04 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.86 -21.4 66.46 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 122.323 -0.236 . . . . 0.0 110.534 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 64.6 mt -71.09 -26.43 63.05 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.329 -0.232 . . . . 0.0 110.44 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.529 ' C ' ' H ' ' B' ' 54' ' ' LYS . 48.6 mt -74.08 -17.28 60.97 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.954 178.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -69.04 17.94 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.065 0.393 . . . . 0.0 111.324 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' B' ' 52' ' ' LEU . 51.9 mtmt -118.47 -2.39 11.06 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.192 0.997 . . . . 0.0 110.931 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -153.83 -14.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.62 170.76 7.21 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 118.353 0.524 . . . . 0.0 111.457 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 44.5 tp -149.72 160.62 43.38 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.328 0.651 . . . . 0.0 109.318 179.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -146.09 173.86 11.81 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.024 0.93 . . . . 0.0 109.803 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 48.7 tp -152.53 157.71 41.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 13.9 p -152.24 141.15 14.0 Favored Pre-proline 0 CA--C 1.53 0.211 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -72.68 169.87 20.88 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.323 2.682 . . . . 0.0 111.31 178.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 . . . . . 0 CA--C 1.534 0.332 0 C-N-CA 125.479 1.511 . . . . 0.0 112.647 -179.996 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp -72.33 -24.79 61.36 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.983 0.913 . . . . 0.0 111.525 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -61.57 -32.03 79.86 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.683 -0.636 . . . . 0.0 112.503 -175.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -75.49 1.44 14.15 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 117.74 0.77 . . . . 0.0 111.852 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -134.09 4.97 3.54 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.559 0.744 . . . . 0.0 110.169 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -111.87 -46.89 3.19 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.813 0.845 . . . . 0.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.441 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -60.37 -43.74 93.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -177.355 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.441 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 75.0 Cg_endo -73.06 -1.49 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.049 1.832 . . . . 0.0 112.495 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -135.03 7.79 3.45 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.02 0.528 . . . . 0.0 110.524 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.417 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 46.4 tp -57.92 -45.15 99.81 Favored Pre-proline 0 N--CA 1.451 -0.397 0 C-N-CA 124.354 1.061 . . . . 0.0 112.904 -178.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 89.2 Cg_endo -77.84 -10.18 16.88 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.935 1.757 . . . . 0.0 112.624 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -65.71 -20.13 66.17 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.953 0.797 . . . . 0.0 111.429 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.1 mt -75.97 -19.09 59.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.72 0.236 . . . . 0.0 110.88 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.28 -18.07 15.63 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.464 0.706 . . . . 0.0 109.666 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.07 -18.74 26.77 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 125.115 1.366 . . . . 0.0 111.231 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -140.39 -14.05 1.0 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 172.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.65 -28.22 71.13 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.21 -10.01 13.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.397 0.679 . . . . 0.0 111.812 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.21 6.31 4.92 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.367 0.667 . . . . 0.0 111.473 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 tp -106.22 -3.91 20.78 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.047 0.539 . . . . 0.0 110.342 178.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 t -147.84 -19.92 0.36 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.022 0.529 . . . . 0.0 111.439 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 22.81 78.67 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.566 -0.574 . . . . 0.0 113.849 172.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.8 t -146.06 134.77 22.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 118.227 1.014 . . . . 0.0 110.204 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -72.14 -26.49 62.12 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.71 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -73.43 -34.04 65.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -77.05 -39.76 48.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 177.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.23 -36.61 92.0 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -72.02 -36.5 69.69 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.667 0.734 . . . . 0.0 111.246 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -22.91 36.57 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.403 -178.031 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.94 -44.49 63.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.709 0.686 . . . . 0.0 110.357 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.36 -34.69 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-N 118.549 0.613 . . . . 0.0 110.967 -178.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.54 -32.08 47.77 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.937 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.76 -26.71 60.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 175.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 67.4 m -67.01 -37.57 84.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -43.92 44.23 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -62.67 -25.55 68.2 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.96 -0.463 . . . . 0.0 110.571 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.28 0.19 23.05 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.223 0.609 . . . . 0.0 111.648 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.03 -14.31 7.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.41 0.684 . . . . 0.0 109.99 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 38.2 t -58.3 -14.56 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 123.452 0.701 . . . . 0.0 111.527 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.06 2.28 9.28 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.053 0.541 . . . . 0.0 111.53 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.83 54.56 1.05 Allowed Pre-proline 0 CA--C 1.533 0.304 0 C-N-CA 123.008 0.523 . . . . 0.0 111.28 -177.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.08 -10.99 27.74 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.886 2.391 . . . . 0.0 112.479 -177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.97 -9.64 58.83 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.773 0.429 . . . . 0.0 110.906 176.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -96.93 7.21 47.14 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.4 0.68 . . . . 0.0 111.037 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -129.8 60.63 53.04 Favored Pre-proline 0 CA--C 1.533 0.293 0 C-N-CA 122.666 0.386 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.429 ' C ' ' HD3' ' A' ' 48' ' ' ARG . 92.3 Cg_endo -73.7 163.39 37.41 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.785 2.99 . . . . 0.0 111.109 178.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.429 ' HD3' ' C ' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -138.34 3.83 2.39 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.417 0.687 . . . . 0.0 111.072 179.432 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.45 -17.91 63.0 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 m -73.05 -49.14 40.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -164.59 152.3 10.39 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 126.545 1.938 . . . . 0.0 107.127 172.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.9 3.15 4.08 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 123.472 2.781 . . . . 0.0 112.449 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -136.0 -21.25 1.44 Allowed 'General case' 0 C--N 1.341 0.21 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -176.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.6 tp -68.76 -29.52 67.93 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.39 0.541 . . . . 0.0 110.989 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.29 -34.02 33.92 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.52 -42.45 92.28 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.114 0.457 . . . . 0.0 110.185 177.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -77.0 -31.8 56.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.22 -37.86 86.55 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.989 0.359 . . . . 0.0 111.634 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.2 mmm -80.52 -34.76 35.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.314 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -67.38 -42.43 83.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.322 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -72.49 -20.18 61.41 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.434 -0.506 . . . . 0.0 110.584 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.08 -40.36 95.06 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -70.89 -39.0 74.8 Favored 'Isoleucine or valine' 0 C--N 1.338 0.084 0 CA-C-N 117.447 0.624 . . . . 0.0 109.599 177.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -66.93 -40.17 87.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -23.55 62.21 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.415 0.286 . . . . 0.0 111.192 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.4 t -84.14 -20.18 32.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.16 0.184 . . . . 0.0 110.633 177.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.66 -49.14 13.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.379 -0.201 . . . . 0.0 111.385 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.7 p30 -75.2 -13.05 60.42 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.188 -0.32 . . . . 0.0 111.453 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.19 3.21 40.25 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.314 0.646 . . . . 0.0 111.517 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -139.61 3.36 2.08 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.95 0.5 . . . . 0.0 111.359 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.13 4.66 83.94 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 122.978 0.323 . . . . 0.0 112.823 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.48 1.85 18.02 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 117.499 0.65 . . . . 0.0 111.277 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.23 21.42 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.025 0.53 . . . . 0.0 110.608 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -145.6 -176.76 5.25 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.352 1.061 . . . . 0.0 109.084 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -56.62 155.72 7.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.919 0.488 . . . . 0.0 111.137 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.0 p -70.82 168.47 16.69 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.584 0.707 . . . . 0.0 111.895 -177.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -156.15 -166.85 2.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.309 1.043 . . . . 0.0 108.854 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 72.6 p -145.18 168.43 20.41 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.564 0.346 . . . . 0.0 110.98 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -143.06 20.27 1.94 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.256 0.622 . . . . 0.0 111.304 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -130.87 -166.27 1.67 Allowed 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 123.769 0.828 . . . . 0.0 109.882 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -142.39 11.41 1.91 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.75 16.01 0.06 OUTLIER Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.154 -1.022 . . . . 0.0 115.513 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.8 t -147.4 -3.04 0.56 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.173 1.487 . . . . 0.0 113.181 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.49 -31.34 0.11 Allowed 'General case' 0 C--N 1.334 -0.079 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -71.95 -20.17 61.78 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 171.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.3 p -70.24 -29.53 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.04 0.54 55.05 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.646 0.778 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -115.54 -49.02 2.76 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 124.164 0.986 . . . . 0.0 109.937 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.46 -2.17 6.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 112.462 -175.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.2 mtt-85 -128.77 -7.62 5.04 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.171 0.588 . . . . 0.0 111.77 -177.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 mt -140.3 21.99 2.39 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.182 0.593 . . . . 0.0 111.394 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.4 7.63 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.896 1.278 . . . . 0.0 114.078 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -130.2 -3.43 4.45 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.772 0.715 . . . . 0.0 112.649 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 53.4 ttm -73.79 142.65 46.19 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.493 HG23 ' H ' ' A' ' 98' ' ' SER . 12.4 t -61.89 147.35 89.86 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.38 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.59 1.2 0.06 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 125.217 3.945 . . . . 0.0 117.016 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 25.7 tp -129.19 -26.58 2.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.673 1.124 . . . . 0.0 112.739 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.493 ' H ' HG23 ' A' ' 95' ' ' THR . 73.9 m -68.89 -24.02 64.27 Favored 'General case' 0 C--N 1.337 0.062 0 CA-C-N 119.12 0.873 . . . . 0.0 109.751 175.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -72.66 -25.33 61.23 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 122.183 0.193 . . . . 0.0 110.758 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -80.82 -37.41 30.16 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 176.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.81 -29.96 70.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 176.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.22 -48.41 67.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.502 0.321 . . . . 0.0 110.445 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.411 ' C ' HD12 ' A' ' 103' ' ' LEU . 4.2 pp -73.83 -4.72 36.57 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.185 -0.322 . . . . 0.0 111.444 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.2 tp -103.05 -7.31 21.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.214 0.606 . . . . 0.0 112.22 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 82.5 p -140.63 2.05 1.77 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.5 8.51 5.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.807 0.443 . . . . 0.0 110.688 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 5.0 mtm -143.21 -2.7 0.98 Allowed 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.624 0.77 . . . . 0.0 112.338 -178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -139.95 -14.69 1.04 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.471 0.578 . . . . 0.0 112.072 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.56 8.31 25.54 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.015 176.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -63.87 154.81 32.54 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 118.265 1.032 . . . . 0.0 111.312 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 60.9 m -70.79 157.66 89.73 Favored Pre-proline 0 N--CA 1.456 -0.166 0 C-N-CA 123.172 0.589 . . . . 0.0 109.908 178.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -70.23 -16.16 35.5 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.801 2.334 . . . . 0.0 112.076 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.23 -45.01 43.01 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.234 0.47 . . . . 0.0 111.075 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -82.99 -23.61 33.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.39 -30.1 68.94 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 173.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.94 -32.6 63.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -70.28 -22.85 62.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.766 0.427 . . . . 0.0 110.611 175.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.0 tp -83.4 -7.55 59.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.415 HG13 HG22 ' A' ' 121' ' ' VAL . 23.5 pt -134.92 11.41 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.775 -0.578 . . . . 0.0 110.369 175.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 54.04 59.85 3.99 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.998 1.319 . . . . 0.0 113.364 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.415 HG22 HG13 ' A' ' 119' ' ' ILE . 33.5 m -138.0 -176.19 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 C-N-CA 124.702 1.201 . . . . 0.0 109.336 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -88.66 160.21 17.48 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.6 m -55.97 -40.83 73.84 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 122.745 0.418 . . . . 0.0 111.067 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.5 m -69.81 -20.72 63.44 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.926 0.491 . . . . 0.0 111.787 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.48 -34.38 54.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.424 0.556 . . . . 0.0 110.124 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.3 t -64.98 -36.65 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.061 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.49 -38.45 87.37 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.3 m -71.44 -40.55 70.32 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 119.678 -0.201 . . . . 0.0 110.696 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.02 -34.58 78.34 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.001 0.364 . . . . 0.0 111.82 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -81.17 -27.06 10.61 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.414 0.552 . . . . 0.0 111.032 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 61.6 m -68.95 -37.91 79.12 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -77.13 -25.52 52.18 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 122.275 -0.266 . . . . 0.0 110.658 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.67 -48.4 47.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.399 -0.188 . . . . 0.0 110.557 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.4 -22.61 61.85 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.723 0.238 . . . . 0.0 111.235 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.94 71.34 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.737 0.244 . . . . 0.0 110.371 177.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -75.57 -18.95 59.6 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.875 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.9 mm -78.61 -55.18 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.08 -23.26 67.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.677 0.217 . . . . 0.0 111.194 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.84 -24.35 62.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -158.96 -37.33 0.06 Allowed 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -171.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.7 p . . . . . 0 N--CA 1.47 0.556 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 -169.138 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 . . . . . 0 CA--C 1.528 0.115 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -62.82 -27.78 69.55 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.805 -0.559 . . . . 0.0 111.014 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.34 -37.46 62.97 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.46 -22.11 57.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.44 -0.447 . . . . 0.0 110.85 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.48 -44.23 68.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.856 0.36 . . . . 0.0 110.136 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 68.5 mt -73.71 -37.39 65.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 122.744 0.418 . . . . 0.0 110.095 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.25 -37.76 86.27 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.636 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.1 t -69.49 -37.19 77.11 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 117.74 0.246 . . . . 0.0 111.381 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.89 -30.35 71.45 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 120.545 0.212 . . . . 0.0 111.152 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -105.59 -6.58 19.17 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -67.7 -34.43 76.88 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -57.72 -33.76 68.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.441 0.697 . . . . 0.0 110.345 175.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 23.4 m -67.85 -12.47 60.7 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.183 0.593 . . . . 0.0 112.065 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 44.9 mm -110.2 -12.6 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 118.298 0.499 . . . . 0.0 111.165 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -77.62 25.36 0.19 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.194 0.598 . . . . 0.0 110.991 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -141.52 176.05 9.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.226 0.61 . . . . 0.0 111.374 -178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -66.14 178.06 1.25 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.526 1.131 . . . . 0.0 112.326 -177.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -138.25 156.88 73.51 Favored Pre-proline 0 CA--C 1.531 0.216 0 C-N-CA 123.96 0.904 . . . . 0.0 109.923 -178.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -74.55 176.15 10.11 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 123.058 2.505 . . . . 0.0 110.449 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -147.09 -2.21 0.62 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.16 -23.27 67.07 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.807 -0.558 . . . . 0.0 111.802 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.9 mtm -73.16 -35.27 66.42 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 49' ' ' LEU . 67.7 mt -81.55 -12.32 58.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.713 -0.617 . . . . 0.0 110.084 175.666 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.0 -20.66 61.68 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 171.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.0 -16.24 62.61 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.987 -0.446 . . . . 0.0 110.417 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.433 ' C ' ' H ' ' B' ' 54' ' ' LYS . 29.6 mt -90.51 -17.0 27.82 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 173.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -71.47 16.12 0.11 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.014 0.37 . . . . 0.0 111.468 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.433 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -133.8 9.35 3.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.184 0.993 . . . . 0.0 111.171 177.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 pp -153.83 -11.68 0.14 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.215 0 CA-C-N 119.205 0.911 . . . . 0.0 113.262 -179.305 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.6 p . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.77 -35.43 74.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 122.624 0.37 . . . . 0.0 111.251 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.75 -27.25 73.2 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 -176.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -73.89 -1.16 18.44 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.413 0.606 . . . . 0.0 111.421 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -135.37 4.31 3.15 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.407 0.683 . . . . 0.0 110.797 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tt -114.56 -41.25 3.45 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.975 0.51 . . . . 0.0 110.113 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.439 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.98 -44.65 99.79 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.5 Cg_endo -72.61 -2.49 11.91 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.092 1.861 . . . . 0.0 112.521 -178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -135.01 13.35 3.6 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.995 0.518 . . . . 0.0 110.97 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.431 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 45.9 tp -62.09 -39.57 59.35 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 76.8 Cg_endo -75.77 -11.69 20.1 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.665 1.577 . . . . 0.0 113.316 -176.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.405 ' CE1' HD11 ' B' ' 40' ' ' ILE . 47.8 m-85 -70.26 -22.8 62.84 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.66 0.663 . . . . 0.0 112.553 -173.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.0 -29.8 64.59 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 118.664 0.666 . . . . 0.0 109.59 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -80.51 -28.19 37.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.995 0.518 . . . . 0.0 109.8 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -56.29 -22.53 30.92 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.297 1.039 . . . . 0.0 112.171 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -140.27 -8.83 1.14 Allowed 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 117.812 0.278 . . . . 0.0 111.737 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.86 -28.45 73.06 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -72.29 -4.84 32.03 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.789 0.794 . . . . 0.0 111.655 177.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.45 6.3 5.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.192 0.597 . . . . 0.0 111.374 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.6 tp -99.9 -1.95 36.04 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.208 0.603 . . . . 0.0 110.193 177.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 t -148.05 -0.3 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.889 0.875 . . . . 0.0 110.754 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.98 -0.62 10.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.395 0.998 . . . . 0.0 114.919 173.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.7 m -139.18 134.37 32.69 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.176 1.488 . . . . 0.0 110.086 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -72.31 -23.57 61.19 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.002 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -65.19 -39.19 92.51 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 118.275 0.489 . . . . 0.0 110.501 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -83.43 -31.33 26.68 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.124 0.57 . . . . 0.0 110.127 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.2 -45.68 92.99 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -74.63 -26.4 59.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 117.388 0.594 . . . . 0.0 110.939 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.68 -46.38 72.48 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -64.76 -33.36 75.8 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 117.744 0.247 . . . . 0.0 111.117 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.77 -55.27 24.76 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 117.825 0.284 . . . . 0.0 110.656 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -74.5 -29.17 61.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.119 -176.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -25.04 63.58 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 119.789 -0.148 . . . . 0.0 110.984 177.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.88 -45.67 85.03 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 117.894 0.316 . . . . 0.0 110.231 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.6 tt -80.55 -36.45 33.01 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 119.839 -0.744 . . . . 0.0 111.564 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.94 -27.03 68.54 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.341 0.518 . . . . 0.0 110.242 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.45 -1.19 25.86 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.244 0.618 . . . . 0.0 111.662 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.0 mt -118.98 -13.56 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.725 0.81 . . . . 0.0 110.082 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -58.59 -12.31 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.694 0.798 . . . . 0.0 111.799 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.26 3.3 9.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.321 0.649 . . . . 0.0 111.42 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.41 55.26 1.03 Allowed Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.561 0.745 . . . . 0.0 110.531 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.87 -8.93 21.2 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.512 2.808 . . . . 0.0 112.759 -174.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -80.47 -8.58 59.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.776 0.43 . . . . 0.0 111.403 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -88.44 -17.18 30.97 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.294 0.237 . . . . 0.0 111.633 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.52 120.2 80.66 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -53.69 139.68 67.32 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.282 2.655 . . . . 0.0 112.389 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 54.3 mmm-85 -141.69 16.63 2.16 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.779 1.232 . . . . 0.0 110.084 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -128.17 20.85 6.3 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.95 0.9 . . . . 0.0 110.78 -175.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.2 m -139.37 -178.28 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 124.528 1.131 . . . . 0.0 108.999 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -53.79 146.96 24.75 Favored Pre-proline 0 CA--C 1.531 0.233 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.9 11.31 0.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 123.884 3.056 . . . . 0.0 111.676 -176.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -127.94 -22.21 3.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.631 0.773 . . . . 0.0 111.022 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.8 tp -74.42 -34.36 63.21 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.173 0.442 . . . . 0.0 110.251 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.71 -30.4 61.89 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.43 -43.58 93.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.203 0.601 . . . . 0.0 110.111 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -81.01 -29.78 35.08 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -177.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.24 -40.63 90.37 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 117.897 0.317 . . . . 0.0 111.129 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.3 mmm -74.94 -35.74 62.13 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -66.75 -35.91 81.21 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 117.529 0.149 . . . . 0.0 110.647 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -68.71 -27.36 65.88 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.866 0.466 . . . . 0.0 110.017 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.58 -37.32 84.96 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.593 -0.603 . . . . 0.0 111.593 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.7 mm -72.39 -38.91 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.067 0 CA-C-N 118.014 0.907 . . . . 0.0 110.323 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -69.74 -35.5 75.03 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.23 -0.294 . . . . 0.0 110.584 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.31 -28.15 66.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 122.166 -0.333 . . . . 0.0 110.58 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -80.34 -28.06 38.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.429 0.291 . . . . 0.0 110.878 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.63 -32.26 67.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.227 -0.295 . . . . 0.0 111.11 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -87.01 -12.49 47.26 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.406 0.282 . . . . 0.0 110.876 177.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.8 5.55 43.09 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.183 0.593 . . . . 0.0 110.877 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -134.99 1.75 3.03 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.27 0.628 . . . . 0.0 111.027 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.58 25.97 74.97 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-O 119.618 -0.545 . . . . 0.0 112.572 176.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -61.58 -16.35 47.31 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.847 0.823 . . . . 0.0 111.17 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.23 164.2 39.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.561 0.744 . . . . 0.0 110.305 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -141.35 4.27 1.78 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.844 0.858 . . . . 0.0 110.513 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.1 t -159.27 -172.15 3.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.254 1.021 . . . . 0.0 108.921 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 87.0 p -130.61 -19.0 3.06 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.225 -0.417 . . . . 0.0 111.609 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 58.04 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 174.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 74.2 m 57.41 168.72 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.899 1.28 . . . . 0.0 113.215 -171.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -149.7 16.26 0.88 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.466 0.706 . . . . 0.0 110.936 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.92 -176.39 4.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.925 0.49 . . . . 0.0 110.289 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -138.87 7.56 2.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.753 0.421 . . . . 0.0 111.857 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -172.51 12.42 0.04 OUTLIER Glycine 0 CA--C 1.529 0.918 0 CA-C-O 119.208 -0.774 . . . . 0.0 114.44 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.7 t -145.93 -0.63 0.8 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.845 1.322 . . . . 0.0 112.81 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -149.68 -45.92 0.13 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.08 -24.37 67.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.24 -28.59 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 O-C-N 122.117 -0.364 . . . . 0.0 110.545 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.63 -0.35 56.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.76 -21.09 2.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 118.168 0.44 . . . . 0.0 111.867 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -81.11 -1.94 46.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.071 0.548 . . . . 0.0 110.962 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.443 ' C ' HD12 ' A' ' 91' ' ' LEU . 74.5 mtp180 -129.19 -9.97 4.74 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.111 0.564 . . . . 0.0 111.734 -177.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.443 HD12 ' C ' ' A' ' 90' ' ' ARG . 10.8 mp -126.16 7.01 7.16 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.839 0.856 . . . . 0.0 111.43 -174.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.13 -9.31 1.96 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -75.21 -0.82 20.72 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.017 0.527 . . . . 0.0 111.225 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 72.0 mtm -121.13 162.48 20.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 122.94 0.496 . . . . 0.0 111.238 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 97' ' ' LEU . 28.6 m -67.29 144.21 97.95 Favored Pre-proline 0 N--CA 1.453 -0.303 0 C-N-CA 123.749 0.819 . . . . 0.0 110.585 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 53.9 Cg_exo -54.59 5.26 0.04 OUTLIER 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 124.829 3.686 . . . . 0.0 115.344 173.117 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.427 ' H ' ' C ' ' A' ' 95' ' ' THR . 3.3 tm? -123.71 -37.25 2.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.462 0.574 . . . . 0.0 110.086 -174.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 p -67.68 -20.79 65.33 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.307 0.503 . . . . 0.0 110.257 175.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 33.6 mtp-105 -71.7 -23.56 61.66 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.656 0.207 . . . . 0.0 110.839 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -78.99 -38.07 37.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -66.27 -29.78 70.07 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.41 ' C ' HD13 ' A' ' 102' ' ' LEU . 3.4 tm? -62.91 -51.3 67.47 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.17 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.86 -4.92 37.84 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 71.2 mt -95.3 -7.43 38.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.26 0.482 . . . . 0.0 111.951 174.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 65.1 p -136.07 8.12 3.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.558 0.617 . . . . 0.0 112.488 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.09 7.66 2.68 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.929 0.491 . . . . 0.0 110.847 176.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.5 tpp -136.05 -15.07 1.77 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -150.6 -21.81 0.23 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.437 0.562 . . . . 0.0 112.397 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 84.32 19.86 59.82 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 119.396 -0.669 . . . . 0.0 113.615 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -56.7 148.51 20.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.371 1.085 . . . . 0.0 110.708 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.3 m -72.68 153.41 91.49 Favored Pre-proline 0 CA--C 1.53 0.206 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -52.65 -30.11 44.34 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.459 2.773 . . . . 0.0 113.252 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.03 -33.9 72.59 Favored 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.749 -0.594 . . . . 0.0 110.808 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -83.26 -36.7 24.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.17 -31.04 68.34 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.916 -0.129 . . . . 0.0 111.24 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.32 -36.54 61.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.879 0.309 . . . . 0.0 110.794 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -69.41 -23.07 63.65 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.78 0.432 . . . . 0.0 111.211 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 23.6 tp -87.7 -3.29 58.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.981 0.512 . . . . 0.0 111.782 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.42 HG13 HG22 ' A' ' 121' ' ' VAL . 14.0 pt -134.38 10.66 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.986 -0.446 . . . . 0.0 110.793 178.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 59.43 50.89 7.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.444 1.098 . . . . 0.0 113.561 173.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.42 HG22 HG13 ' A' ' 119' ' ' ILE . 28.7 m -136.03 174.66 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 C-N-CA 123.482 0.713 . . . . 0.0 110.189 175.012 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.17 157.38 36.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.8 m -59.46 -36.58 76.24 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.138 -0.351 . . . . 0.0 110.99 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.7 t -74.28 -23.81 59.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.004 -0.435 . . . . 0.0 111.072 -179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.35 -42.5 65.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.963 -0.461 . . . . 0.0 110.621 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.4 p -68.11 -29.68 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.454 -178.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.23 -37.94 87.28 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 176.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 88.8 m -77.11 -36.53 55.52 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 122.382 -0.199 . . . . 0.0 110.488 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.14 -30.78 71.33 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.135 -0.459 . . . . 0.0 111.505 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.0 m -82.77 -27.69 8.31 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 118.903 0.774 . . . . 0.0 110.805 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 84.5 m -68.1 -38.71 82.6 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -76.7 -27.02 55.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 122.125 -0.359 . . . . 0.0 110.615 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.42 -49.06 45.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.23 -22.92 63.82 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 122.152 -0.342 . . . . 0.0 111.303 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.79 71.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -75.84 -18.9 59.28 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.532 -0.27 . . . . 0.0 111.105 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.0 mm -75.54 -55.38 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 118.402 0.546 . . . . 0.0 109.597 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -65.34 -18.42 65.3 Favored 'General case' 0 CA--C 1.527 0.083 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -75.19 -22.07 58.26 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -159.71 -37.45 0.06 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -171.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.468 0.47 0 C-N-CA 123.822 0.849 . . . . 0.0 112.517 -169.599 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 CA--C 1.53 0.21 0 CA-C-O 120.59 0.233 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -59.35 -28.06 66.5 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.275 0.63 . . . . 0.0 112.017 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -69.07 -30.46 72.05 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.43 -15.73 48.54 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.738 0.769 . . . . 0.0 110.687 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.33 -46.31 16.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 mt -68.94 -38.7 79.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.695 177.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -67.69 -29.2 68.41 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.155 -0.45 . . . . 0.0 110.921 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.1 t -67.73 -44.45 77.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.728 0.695 . . . . 0.0 110.312 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.2 -24.41 67.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.248 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -107.44 -9.51 15.96 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -70.36 -36.07 73.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 173.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -69.2 -21.23 63.97 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.24 -0.288 . . . . 0.0 111.143 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 58.7 m -75.79 -10.8 59.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.274 0.629 . . . . 0.0 111.389 177.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.405 HD11 ' CE1' ' A' ' 13' ' ' PHE . 19.1 tt -123.94 30.03 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 122.181 0.991 . . . . 0.0 110.018 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -128.41 28.91 5.39 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.43 0.692 . . . . 0.0 109.574 176.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -142.46 -176.24 4.77 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.662 0.785 . . . . 0.0 110.279 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -60.34 178.79 0.18 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.07 0.948 . . . . 0.0 112.91 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.07 155.64 74.35 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.238 -175.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -76.8 59.09 6.24 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 124.499 3.466 . . . . 0.0 110.533 175.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -59.85 -9.51 2.99 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.609 0.764 . . . . 0.0 111.607 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -56.62 -23.37 40.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.242 0.617 . . . . 0.0 111.619 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 19.3 ptp -75.92 -29.08 58.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.844 -0.535 . . . . 0.0 110.813 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 49' ' ' LEU . 64.4 mt -80.39 -11.19 59.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 121.615 -0.678 . . . . 0.0 109.461 174.099 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.78 -20.29 61.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 168.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 50.4 mt -78.45 -8.53 58.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.432 0.293 . . . . 0.0 110.247 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -90.42 -18.77 24.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 171.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -74.24 13.7 0.53 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.665 0.386 . . . . 0.0 111.251 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -130.97 13.3 5.24 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.119 0.968 . . . . 0.0 109.894 174.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.3 mt -137.5 -26.87 0.97 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.533 0.733 . . . . 0.0 111.394 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.233 0 CA-C-N 117.884 0.311 . . . . 0.0 111.581 -179.861 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 CA--C 1.53 0.208 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.9 tp 61.43 -38.9 0.12 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.476 2.31 . . . . 0.0 114.847 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.6 -24.92 64.05 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 119.105 0.866 . . . . 0.0 112.51 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -68.85 -2.1 8.79 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 117.597 0.698 . . . . 0.0 111.126 177.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -131.01 -21.49 2.67 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.253 0.621 . . . . 0.0 110.974 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 tp -77.91 -44.87 25.74 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.138 -0.351 . . . . 0.0 110.36 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.418 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.29 -46.26 99.84 Favored Pre-proline 0 CA--C 1.534 0.346 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -173.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.418 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 88.4 Cg_endo -74.69 -0.24 9.57 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.307 2.005 . . . . 0.0 112.541 -176.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -133.65 13.29 4.07 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.411 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 42.2 mt -55.05 -43.54 99.12 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.411 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 69.5 Cg_endo -81.12 -12.54 11.74 Favored 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 121.919 1.746 . . . . 0.0 114.016 -170.446 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -66.03 -23.15 66.5 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 119.123 0.874 . . . . 0.0 111.843 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.417 HD12 ' N ' ' A' ' 14' ' ' LEU . 8.0 mp -69.76 -18.85 63.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 118.089 0.404 . . . . 0.0 110.557 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -98.27 -20.7 17.08 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -58.24 -22.26 51.57 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 123.682 0.793 . . . . 0.0 111.57 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -140.09 -24.93 0.81 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.247 0.219 . . . . 0.0 111.3 177.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -61.33 -29.0 70.27 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -65.47 -32.77 74.57 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.114 0.457 . . . . 0.0 110.635 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.47 -6.21 52.69 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.485 0.314 . . . . 0.0 111.833 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.0 mt -97.44 4.7 50.47 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -155.36 -15.8 0.11 Allowed 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.06 25.34 75.49 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.577 -0.702 . . . . 0.0 112.758 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.4 t -150.67 139.95 21.29 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.188 0.994 . . . . 0.0 110.948 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -81.16 -20.2 41.79 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.425 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -71.82 -36.54 70.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -76.63 -32.3 57.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.22 -43.31 89.55 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -67.92 -31.94 72.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 117.071 0.435 . . . . 0.0 110.633 178.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -71.27 -42.51 68.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.379 0.272 . . . . 0.0 110.406 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -65.3 -41.41 94.13 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.576 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.0 m -68.61 -37.7 78.0 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.127 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.327 -176.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -78.8 -29.8 45.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.577 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.32 -26.58 62.0 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.302 -0.259 . . . . 0.0 110.302 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.2 m -65.59 -40.82 93.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.428 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -75.45 -41.78 54.89 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 110.272 -0.269 . . . . 0.0 110.272 -176.814 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.92 -24.95 68.09 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.903 -0.498 . . . . 0.0 110.649 -178.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.75 0.46 26.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.39 0.676 . . . . 0.0 111.594 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.1 mt -122.41 -14.85 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.112 0.965 . . . . 0.0 109.977 -176.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.8 -14.83 7.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.463 0.705 . . . . 0.0 111.053 175.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.69 4.41 9.51 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.413 0.685 . . . . 0.0 110.933 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.74 53.05 0.89 Allowed Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.39 0.676 . . . . 0.0 111.295 -176.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -65.01 -10.72 26.62 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.24 2.627 . . . . 0.0 112.55 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -74.87 -13.84 60.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.53 0.332 . . . . 0.0 111.255 176.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -90.05 2.8 54.8 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.048 0.539 . . . . 0.0 111.533 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -133.77 65.08 69.84 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 122.483 0.313 . . . . 0.0 111.135 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -76.39 179.95 5.89 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 124.681 3.587 . . . . 0.0 111.396 -175.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 78.7 mmt-85 -132.56 16.42 4.4 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.662 1.185 . . . . 0.0 109.823 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -71.86 8.89 1.04 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.185 0.994 . . . . 0.0 110.902 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.63 178.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 C-N-CA 124.974 1.309 . . . . 0.0 108.693 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -53.73 146.09 27.88 Favored Pre-proline 0 CA--C 1.529 0.166 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -70.18 10.77 0.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.979 3.119 . . . . 0.0 111.983 -175.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -132.63 -17.53 2.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.325 0.65 . . . . 0.0 111.127 179.005 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 54.1 tp -75.93 -36.41 59.4 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.374 0.534 . . . . 0.0 110.558 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.81 -32.07 54.51 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -58.6 -42.84 89.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.768 0.827 . . . . 0.0 109.854 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 -79.61 -28.6 40.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -66.94 -41.27 87.26 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.242 0.474 . . . . 0.0 111.257 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 93.4 mmm -75.37 -32.27 60.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.241 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -68.67 -35.93 77.87 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.92 -26.86 67.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.773 0.429 . . . . 0.0 110.117 177.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.84 -38.36 65.69 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.7 mm -74.44 -35.98 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 CA-C-N 117.886 0.843 . . . . 0.0 110.046 177.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -67.68 -32.15 72.62 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.501 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.22 -32.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.937 -0.477 . . . . 0.0 110.207 175.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.1 t -73.22 -26.37 61.11 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.74 -30.86 51.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.334 0.253 . . . . 0.0 110.454 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -76.65 -15.12 59.9 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.107 -0.371 . . . . 0.0 110.314 173.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -93.05 7.58 43.54 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.608 0.763 . . . . 0.0 110.628 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -138.31 0.54 2.11 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.287 0.635 . . . . 0.0 111.39 -179.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.92 33.2 46.76 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.641 -0.533 . . . . 0.0 112.525 175.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -123.47 10.7 9.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.017 0.909 . . . . 0.0 111.253 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.73 24.28 1.53 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.874 0.469 . . . . 0.0 111.205 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -102.66 6.3 39.55 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.07 0.548 . . . . 0.0 110.809 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.8 t -155.08 174.37 15.27 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.497 0.719 . . . . 0.0 109.824 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -154.15 176.4 12.3 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.305 0.642 . . . . 0.0 110.816 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -145.94 -12.82 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.972 0.509 . . . . 0.0 112.009 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 m 61.5 168.16 0.1 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.663 1.185 . . . . 0.0 112.817 -173.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -144.69 14.42 1.56 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.03 0.932 . . . . 0.0 110.507 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.3 -179.3 6.75 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.919 0.888 . . . . 0.0 109.578 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -136.34 11.98 3.26 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.441 0.296 . . . . 0.0 111.707 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -164.27 12.08 0.09 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 119.394 -0.67 . . . . 0.0 113.827 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -149.78 7.91 0.66 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 1.127 . . . . 0.0 111.63 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -150.3 -48.24 0.13 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.35 -28.21 41.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 122.553 0.341 . . . . 0.0 110.819 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.8 0.76 55.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.096 0.558 . . . . 0.0 111.926 -178.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -121.48 -39.89 2.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.861 0.465 . . . . 0.0 110.012 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.35 -1.31 7.93 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -130.11 -2.95 4.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.221 0.608 . . . . 0.0 111.337 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 61.8 mt -137.52 20.17 2.91 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.918 0.887 . . . . 0.0 111.13 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.06 4.49 0.05 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -175.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -129.4 0.47 5.06 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.091 0.86 . . . . 0.0 112.085 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 54.5 ttm -71.55 149.55 45.61 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.8 m -57.43 140.11 79.92 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 123.648 0.779 . . . . 0.0 109.707 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.54 5.4 0.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.031 3.154 . . . . 0.0 113.919 -176.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.3 tp -128.97 -22.99 3.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.477 0.581 . . . . 0.0 110.682 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 71.0 m -69.32 -22.89 63.75 Favored 'General case' 0 N--CA 1.457 -0.075 0 O-C-N 121.891 -0.505 . . . . 0.0 109.922 174.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 40.4 mtp-105 -68.05 -32.54 72.96 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 175.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -76.39 -39.0 54.88 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.07 -30.45 71.52 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.1 tp -66.84 -46.59 74.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.402 0.281 . . . . 0.0 110.283 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.0 mt -74.89 -8.94 57.97 Favored 'General case' 0 N--CA 1.46 0.04 0 O-C-N 122.13 -0.356 . . . . 0.0 110.73 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -95.67 -8.4 34.83 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -140.65 -20.34 0.83 Allowed 'General case' 0 C--N 1.339 0.121 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.53 -10.85 58.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.121 0.873 . . . . 0.0 111.591 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 16.1 ptp -149.83 11.3 0.74 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -174.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -138.08 -13.13 1.42 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.856 0.753 . . . . 0.0 112.15 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.84 10.04 36.59 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.009 -0.884 . . . . 0.0 114.493 173.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -59.2 150.44 25.53 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 118.808 1.304 . . . . 0.0 110.132 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 94.4 p -67.87 157.19 87.44 Favored Pre-proline 0 N--CA 1.454 -0.235 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.246 179.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -69.45 -16.17 38.7 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 122.775 2.317 . . . . 0.0 110.866 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -79.16 -44.73 21.37 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.63 0.372 . . . . 0.0 110.733 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -78.67 -27.52 45.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.959 -0.463 . . . . 0.0 109.865 177.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.96 -27.64 64.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.905 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.64 -32.55 60.26 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 110.423 -0.214 . . . . 0.0 110.423 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -70.02 -28.95 65.91 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.635 0.374 . . . . 0.0 110.349 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 17.3 tp -76.87 -9.04 58.41 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 21.1 pt -134.98 12.29 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 117.931 0.332 . . . . 0.0 110.812 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 52.34 60.8 3.56 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.904 1.281 . . . . 0.0 113.7 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.36 -175.28 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.43 1.092 . . . . 0.0 109.492 175.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -88.4 160.64 17.48 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.8 m -56.32 -40.49 74.48 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 122.115 -0.365 . . . . 0.0 111.341 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 51.9 m -70.54 -20.54 62.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.688 0.395 . . . . 0.0 111.907 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.91 -37.7 62.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 121.954 -0.466 . . . . 0.0 109.834 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.63 -38.68 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.01 -33.02 74.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.79 -0.078 . . . . 0.0 110.79 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 91.4 m -78.12 -39.66 40.6 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -34.03 77.42 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 119.331 -0.366 . . . . 0.0 111.184 -179.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.5 m -80.49 -27.54 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 CA-C-N 118.515 0.598 . . . . 0.0 110.993 178.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.9 m -69.23 -38.78 78.7 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 178.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -76.04 -25.65 55.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.28 -47.85 46.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 117.674 0.216 . . . . 0.0 110.432 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.7 -22.77 65.25 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.337 0.517 . . . . 0.0 111.264 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -77.41 -34.38 54.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.91 0.386 . . . . 0.0 110.587 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -77.39 -27.46 52.49 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 123.366 0.666 . . . . 0.0 110.094 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.9 mm -66.66 -60.07 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.19 -23.69 67.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -171.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -71.9 -10.2 59.44 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -151.53 -50.07 0.12 Allowed 'General case' 0 C--N 1.34 0.19 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 42.9 p . . . . . 0 N--CA 1.47 0.554 0 C-N-CA 127.698 2.399 . . . . 0.0 117.371 -171.995 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 CA--C 1.527 0.061 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.7 tpt -67.02 -25.23 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.708 0.686 . . . . 0.0 110.707 178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.6 -29.55 65.52 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.14 -27.08 59.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 117.234 0.517 . . . . 0.0 110.549 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.67 -41.52 71.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.38 -43.01 70.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.013 0.525 . . . . 0.0 110.341 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -69.43 -29.79 67.59 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 119.041 -0.505 . . . . 0.0 111.246 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.2 t -65.9 -43.59 87.76 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 118.863 0.756 . . . . 0.0 110.191 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.56 71.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.595 0.236 . . . . 0.0 110.666 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -100.49 -3.13 31.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.183 -0.323 . . . . 0.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -70.42 -31.95 69.36 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -62.86 -33.0 74.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 172.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 20.6 m -81.22 -4.06 54.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.756 0.823 . . . . 0.0 113.101 -177.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 10.4 tp -119.54 -12.02 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 119.166 0.893 . . . . 0.0 112.262 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -83.18 -3.68 57.62 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.897 -0.502 . . . . 0.0 111.172 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.78 170.58 15.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.612 0.72 . . . . 0.0 111.799 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -71.89 -173.76 1.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.068 0.947 . . . . 0.0 110.284 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.9 m -131.58 149.46 73.56 Favored Pre-proline 0 C--O 1.232 0.161 0 C-N-CA 122.608 0.363 . . . . 0.0 110.114 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -76.5 -27.86 7.3 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.291 2.661 . . . . 0.0 113.437 -175.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.5 t70 52.53 -2.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.038 1.735 . . . . 0.0 115.138 -178.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -67.54 -17.04 64.5 Favored 'General case' 0 N--CA 1.457 -0.111 0 O-C-N 121.112 -0.992 . . . . 0.0 111.399 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 28.1 mtm -71.05 -31.25 67.64 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.324 -0.235 . . . . 0.0 110.401 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -85.87 -9.72 56.51 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.977 -0.452 . . . . 0.0 109.959 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -73.13 -20.21 60.97 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.708 -0.62 . . . . 0.0 109.552 169.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 80.9 mt -77.22 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.566 0.346 . . . . 0.0 110.245 173.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -88.51 -18.59 27.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.764 0.425 . . . . 0.0 109.957 171.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -77.89 18.07 0.52 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.196 0.598 . . . . 0.0 111.867 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -133.5 1.35 3.41 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.769 0.428 . . . . 0.0 111.919 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 pp -154.16 2.59 0.24 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.208 0 CA-C-N 118.605 0.639 . . . . 0.0 112.201 179.199 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.4 p . . . . . 0 CA--C 1.529 0.144 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.94 -35.63 66.86 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.79 0.436 . . . . 0.0 111.527 -178.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.53 -36.02 92.81 Favored Glycine 0 C--N 1.341 0.814 0 O-C-N 121.692 -0.63 . . . . 0.0 111.69 -177.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -73.77 1.87 9.54 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.612 0.765 . . . . 0.0 111.309 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -130.84 1.92 4.38 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.674 0.79 . . . . 0.0 110.955 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.34 -38.15 4.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.293 0.637 . . . . 0.0 109.865 177.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.446 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.29 -43.42 96.62 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.7 Cg_endo -73.34 -1.17 10.23 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.357 2.038 . . . . 0.0 112.867 -176.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -134.14 8.74 3.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.248 0.619 . . . . 0.0 110.409 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.75 -41.87 88.17 Favored Pre-proline 0 N--CA 1.452 -0.362 0 C-N-CA 125.362 1.465 . . . . 0.0 114.141 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.28 -10.76 14.84 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.818 1.679 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -66.94 -20.45 65.9 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.753 -0.592 . . . . 0.0 111.059 -177.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.0 mt -71.8 -21.63 61.68 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.095 0.407 . . . . 0.0 110.71 178.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -94.57 -22.19 18.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -55.8 -27.52 51.55 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 124.579 1.152 . . . . 0.0 111.674 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.9 p90 -140.09 -18.89 0.9 Allowed 'General case' 0 N--CA 1.458 -0.074 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.51 -25.74 74.63 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -81.8 -9.52 59.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.377 0.588 . . . . 0.0 110.978 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -109.4 -1.32 18.5 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.616 0.767 . . . . 0.0 110.497 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.5 tp -89.83 5.96 43.88 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.091 0.956 . . . . 0.0 109.444 175.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.2 p -142.28 -14.26 0.79 Allowed 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.696 0.799 . . . . 0.0 111.902 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.482 ' HA3' ' H ' ' A' ' 77' ' ' GLN . . . 64.04 13.86 54.27 Favored Glycine 0 CA--C 1.53 1.031 0 CA-C-O 119.619 -0.545 . . . . 0.0 112.965 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.5 t -142.06 133.25 26.24 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.887 0.843 . . . . 0.0 110.332 -178.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -70.54 -27.16 63.95 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.168 -177.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -75.03 -35.88 61.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.52 -0.112 . . . . 0.0 110.798 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -75.92 -32.4 59.58 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.504 -0.122 . . . . 0.0 110.894 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.3 -42.45 42.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -71.91 -27.89 63.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.591 0.696 . . . . 0.0 111.375 -177.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.71 -26.28 34.76 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.782 0.719 . . . . 0.0 111.747 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -73.8 -31.21 63.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.812 0.733 . . . . 0.0 109.897 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.411 HG12 ' SD ' ' B' ' 48' ' ' MET . 26.6 t -63.92 -51.88 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 177.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -73.99 -27.78 61.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.409 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.98 -25.09 61.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 117.461 0.118 . . . . 0.0 110.734 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 69.3 m -65.02 -45.37 85.81 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 119.093 -0.479 . . . . 0.0 110.327 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.438 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -72.88 -35.18 67.1 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.605 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -62.91 -23.95 67.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.532 -0.73 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.8 -0.1 33.11 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.82 0.448 . . . . 0.0 111.687 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 19.5 mm -110.87 -19.55 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.373 0.669 . . . . 0.0 109.494 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.68 -13.76 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 124.137 0.975 . . . . 0.0 113.076 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 2.24 9.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.859 -0.526 . . . . 0.0 111.181 -178.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -160.55 59.17 1.15 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 C-N-CA 123.136 0.574 . . . . 0.0 110.419 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -65.28 -10.72 27.02 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.441 2.761 . . . . 0.0 112.679 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -76.35 -13.12 60.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.963 0.505 . . . . 0.0 111.446 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -80.11 -22.62 41.94 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.044 0.383 . . . . 0.0 111.463 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -78.36 121.59 83.99 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -50.44 142.55 29.87 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.558 2.839 . . . . 0.0 112.998 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.0 mmt85 -134.98 8.94 3.52 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.934 0.894 . . . . 0.0 109.433 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -139.69 20.82 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.506 1.122 . . . . 0.0 110.819 -173.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 51' ' ' ASP . 4.5 t -133.4 170.57 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.418 ' H ' HG12 ' A' ' 50' ' ' VAL . 9.5 m-20 -53.26 144.54 29.53 Favored Pre-proline 0 N--CA 1.455 -0.209 0 O-C-N 122.127 -0.358 . . . . 0.0 110.604 -179.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.9 11.87 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 124.176 3.251 . . . . 0.0 112.008 -175.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -131.14 -27.08 2.06 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.378 0.671 . . . . 0.0 110.512 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.54 -36.86 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.05 -0.406 . . . . 0.0 110.261 177.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.13 -32.95 65.3 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -58.91 -45.25 90.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.283 0.633 . . . . 0.0 109.718 175.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -76.07 -25.92 55.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.895 -176.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -68.67 -42.54 77.74 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.534 0.607 . . . . 0.0 111.624 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 81.3 mmm -73.21 -33.52 65.42 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.488 0.585 . . . . 0.0 110.948 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -67.78 -38.92 84.01 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.495 177.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -66.86 -25.3 66.34 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.21 -36.92 71.57 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.3 mm -70.38 -41.02 78.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 117.794 0.797 . . . . 0.0 110.011 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -70.21 -34.03 72.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.643 -0.132 . . . . 0.0 110.643 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.35 -33.46 74.32 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.053 -0.404 . . . . 0.0 110.437 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.2 t -73.36 -30.63 63.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.14 -28.02 65.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.317 0.247 . . . . 0.0 111.024 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -89.43 -13.2 38.18 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.424 0.289 . . . . 0.0 110.934 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.84 2.03 47.44 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.011 0.525 . . . . 0.0 111.751 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -140.09 2.35 1.91 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.635 0.374 . . . . 0.0 111.275 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.05 85.68 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.944 -0.473 . . . . 0.0 113.228 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.16 -11.76 51.42 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 117.835 0.817 . . . . 0.0 111.668 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.09 135.7 12.48 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.416 0.686 . . . . 0.0 109.333 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -148.99 4.04 0.62 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.359 0.664 . . . . 0.0 111.368 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -158.43 -172.77 3.99 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.939 0.496 . . . . 0.0 110.159 -175.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.0 p -138.44 -177.27 4.78 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.536 0.734 . . . . 0.0 110.222 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLN . . . . . 0.63 ' HG2' ' H ' ' A' ' 78' ' ' SER . 33.7 tt0 -139.44 -170.03 2.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 122.862 0.465 . . . . 0.0 110.286 -174.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.63 ' H ' ' HG2' ' A' ' 77' ' ' GLN . 66.1 m -130.97 50.98 2.18 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.798 0.839 . . . . 0.0 110.311 -176.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -70.57 25.87 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.341 1.056 . . . . 0.0 112.225 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.452 ' H ' ' C ' ' A' ' 78' ' ' SER . . . -147.46 -178.78 6.43 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.944 1.298 . . . . 0.0 108.993 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.72 4.87 2.37 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -176.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.61 22.45 0.02 OUTLIER Glycine 0 CA--C 1.527 0.792 0 C-N-CA 120.27 -0.967 . . . . 0.0 114.279 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.4 t -146.93 -15.62 0.41 Allowed 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.668 1.234 . . . . 0.0 113.222 -177.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -141.22 -39.6 0.4 Allowed 'General case' 0 N--CA 1.461 0.104 0 O-C-N 121.694 -0.629 . . . . 0.0 109.729 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.11 -27.18 67.86 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 173.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.73 -24.71 36.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 122.815 0.446 . . . . 0.0 110.668 177.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.88 -0.74 57.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -177.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.62 -23.78 2.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.475 0.579 . . . . 0.0 111.757 174.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.31 -1.62 24.51 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.011 0.524 . . . . 0.0 111.298 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.432 ' C ' HD22 ' A' ' 91' ' ' LEU . 69.8 mtp180 -122.95 -11.59 8.09 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 122.972 0.509 . . . . 0.0 111.034 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.492 HD11 HD13 ' A' ' 137' ' ' ILE . 3.0 mm? -130.08 29.56 4.91 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.198 0.999 . . . . 0.0 110.325 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.97 10.39 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.655 1.182 . . . . 0.0 113.726 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.428 ' H ' ' C ' ' A' ' 91' ' ' LEU . 87.9 mmt-85 -130.08 0.18 4.69 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.413 0.685 . . . . 0.0 111.513 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.1 ttm -83.56 149.79 26.36 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.721 0.408 . . . . 0.0 110.432 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.1 m -63.52 138.97 97.51 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 123.722 0.809 . . . . 0.0 109.878 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.85 5.79 1.24 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.058 3.172 . . . . 0.0 113.364 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -121.3 -38.13 2.84 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.4 m -69.28 -24.23 63.93 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.835 -0.54 . . . . 0.0 109.955 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -70.73 -36.17 73.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.175 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -80.74 -24.1 38.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 118.613 0.642 . . . . 0.0 110.233 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.14 -33.91 76.47 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 173.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.5 tp -66.95 -41.17 87.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.6 mt -71.49 -5.09 30.5 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.527 0.331 . . . . 0.0 111.207 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 21.2 tp -111.81 -4.76 14.53 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.225 0.61 . . . . 0.0 112.216 -175.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -138.64 5.03 2.4 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -134.38 5.65 3.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.859 0.299 . . . . 0.0 111.518 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.3 mtm -136.91 2.43 2.6 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.637 0.775 . . . . 0.0 111.887 176.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -148.37 -19.64 0.33 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.566 0.621 . . . . 0.0 112.404 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 66.96 15.88 65.54 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-O 119.253 -0.749 . . . . 0.0 113.614 175.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -57.69 154.24 12.01 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.524 1.162 . . . . 0.0 111.453 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -63.31 146.35 96.27 Favored Pre-proline 0 N--CA 1.45 -0.448 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.554 175.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.37 -16.35 51.09 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 122.566 2.177 . . . . 0.0 111.364 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -73.99 -43.52 57.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.969 0.35 . . . . 0.0 110.268 178.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -78.09 -29.63 49.16 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.51 -28.82 67.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.913 -0.13 . . . . 0.0 110.812 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -74.32 -35.24 63.64 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -68.93 -26.26 64.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.659 0.384 . . . . 0.0 111.156 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -80.06 -9.07 59.67 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 18.4 pt -134.79 13.89 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 118.602 0.637 . . . . 0.0 111.371 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 58.97 53.07 5.84 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.683 1.193 . . . . 0.0 114.02 175.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.1 m -137.77 -175.69 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 C-N-CA 123.477 0.711 . . . . 0.0 110.057 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -91.88 162.31 14.48 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 175.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.1 m -58.62 -39.07 79.44 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 122.029 -0.419 . . . . 0.0 111.655 -177.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.8 p -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -74.58 -36.68 63.04 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 177.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.33 -38.05 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -61.79 -37.85 85.88 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.459 0.118 . . . . 0.0 111.001 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.5 m -75.45 -38.41 59.69 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 122.123 -0.36 . . . . 0.0 110.76 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -66.53 -31.97 73.03 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.389 -0.339 . . . . 0.0 111.727 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -82.19 -26.87 9.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 CA-C-N 118.689 0.677 . . . . 0.0 110.732 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 67.0 m -68.37 -35.85 78.33 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -78.22 -27.49 47.76 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.212 -0.305 . . . . 0.0 110.537 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.84 -42.52 70.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.278 -0.264 . . . . 0.0 110.666 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -75.58 -22.24 57.13 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.11 -0.369 . . . . 0.0 111.081 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.27 -36.64 69.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -73.72 -21.32 60.26 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 119.448 -0.311 . . . . 0.0 110.66 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.492 HD13 HD11 ' A' ' 91' ' ' LEU . 11.5 mm -74.14 -53.56 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.335 0.516 . . . . 0.0 109.665 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.95 -22.06 66.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.392 0.277 . . . . 0.0 111.634 -176.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -73.68 -24.89 60.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -157.64 -36.38 0.07 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -168.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 27.7 p . . . . . 0 N--CA 1.466 0.358 0 C-N-CA 124.798 1.239 . . . . 0.0 114.236 -171.884 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 120.442 0.163 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -63.88 -24.2 67.65 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.116 -0.365 . . . . 0.0 110.776 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -73.86 -34.06 56.68 Favored Glycine 0 C--N 1.337 0.612 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.03 -21.55 63.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.265 0.533 . . . . 0.0 110.743 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.45 -41.16 20.17 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.77 -42.11 58.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.448 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -66.28 -33.34 75.52 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.841 -178.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.0 t -66.02 -42.66 89.34 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.475 0.58 . . . . 0.0 109.832 178.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -18.77 65.27 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -107.87 -12.47 15.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.082 -0.386 . . . . 0.0 111.571 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -69.18 -35.87 76.74 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -70.59 -23.13 62.52 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 57.9 m -70.92 -12.22 61.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.959 0.504 . . . . 0.0 111.435 175.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 38.5 pt -131.54 11.64 1.81 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.804 0.442 . . . . 0.0 111.641 -177.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -80.13 21.98 0.55 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.236 0.614 . . . . 0.0 110.553 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -137.7 -179.04 5.51 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.163 0.585 . . . . 0.0 111.107 -174.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -61.63 -179.9 0.21 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.066 0.946 . . . . 0.0 112.094 178.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.77 155.03 81.92 Favored Pre-proline 0 CA--C 1.528 0.113 0 C-N-CA 122.887 0.475 . . . . 0.0 110.016 -177.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -74.73 176.3 9.99 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.102 2.535 . . . . 0.0 110.78 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -146.46 -0.78 0.74 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.466 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -62.38 -24.38 67.34 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.004 0.521 . . . . 0.0 111.569 -179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' MET . . . . . 0.411 ' SD ' HG12 ' A' ' 32' ' ' VAL . 56.7 mtm -78.98 -37.11 40.2 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.577 0.351 . . . . 0.0 110.752 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -80.39 -17.02 53.09 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -69.02 -21.09 64.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.225 -0.297 . . . . 0.0 110.221 171.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -68.53 -20.56 64.57 Favored 'General case' 0 C--O 1.228 -0.052 0 O-C-N 122.024 -0.422 . . . . 0.0 110.03 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.432 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.6 mt -80.46 -21.38 42.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.214 173.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -75.18 10.92 1.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 172.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.432 ' H ' ' C ' ' B' ' 52' ' ' LEU . 37.6 ttpt -120.08 -1.27 10.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.822 1.249 . . . . 0.0 110.112 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -149.43 -13.91 0.29 Allowed 'General case' 0 C--N 1.34 0.184 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.279 0 C-N-CA 123.293 0.637 . . . . 0.0 111.908 179.684 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.7 p . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -63.64 -12.43 33.68 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.57 -27.97 61.88 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -75.3 1.0 14.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.699 0.8 . . . . 0.0 111.193 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -132.27 -1.85 3.57 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.591 0.756 . . . . 0.0 111.262 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.482 HD21 ' CZ ' ' A' ' 46' ' ' PHE . 44.7 mt -111.81 -31.53 6.92 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.585 0.354 . . . . 0.0 111.052 176.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.412 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -71.39 -44.41 13.07 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 83.6 Cg_endo -76.73 -3.86 14.28 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.253 1.969 . . . . 0.0 112.834 -175.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -135.47 14.58 3.45 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 122.949 0.5 . . . . 0.0 110.643 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 16.4 tp -56.0 -39.74 79.66 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -174.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.39 -4.47 13.7 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.083 1.855 . . . . 0.0 112.667 -178.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -65.51 -23.29 66.85 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.665 0.666 . . . . 0.0 111.733 -176.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mp -74.49 -18.8 60.57 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.561 -0.712 . . . . 0.0 110.309 176.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -99.58 -27.92 13.46 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.589 0.356 . . . . 0.0 111.168 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -61.39 -15.67 38.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -140.41 -16.8 0.92 Allowed 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 174.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.46 -26.34 74.3 Favored Glycine 0 C--N 1.338 0.661 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -66.45 -37.63 85.58 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.014 0.907 . . . . 0.0 110.497 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.76 -16.07 54.79 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.529 0.331 . . . . 0.0 111.332 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.4 tp -79.53 -2.21 41.2 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.897 0.479 . . . . 0.0 111.952 -177.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.8 t -147.86 -16.78 0.36 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.907 -0.496 . . . . 0.0 112.333 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.33 11.55 85.4 Favored Glycine 0 CA--C 1.527 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 113.138 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.9 m -142.8 123.26 13.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.141 0.97 . . . . 0.0 110.12 -178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -66.73 -24.1 66.19 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.762 -177.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -68.72 -39.13 80.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.1 0.409 . . . . 0.0 110.891 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -82.36 -31.79 29.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.74 -43.72 95.85 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.57 -33.67 73.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.428 0.614 . . . . 0.0 110.546 178.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.3 -45.63 75.96 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 122.543 0.337 . . . . 0.0 110.968 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -64.13 -34.41 77.99 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.035 0.38 . . . . 0.0 111.032 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.36 -55.07 26.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 117.812 0.278 . . . . 0.0 111.116 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.1 ttp180 -75.51 -27.12 58.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.01 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.02 -26.74 64.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 117.499 0.136 . . . . 0.0 110.758 176.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.8 m -65.87 -38.09 87.88 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.432 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -73.7 -43.19 59.97 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -61.98 -18.57 60.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.848 0.459 . . . . 0.0 110.96 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -86.77 0.3 55.01 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.077 0.551 . . . . 0.0 112.078 177.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 77.6 mt -120.68 -20.9 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 122.724 0.41 . . . . 0.0 111.407 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.9 m -65.88 -4.5 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 118.832 0.742 . . . . 0.0 112.326 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.12 3.64 7.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.647 0.779 . . . . 0.0 110.31 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.0 56.29 1.26 Allowed Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.648 0.779 . . . . 0.0 110.303 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -64.99 -10.96 27.52 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.005 2.47 . . . . 0.0 111.782 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.26 -16.46 62.48 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.968 -0.457 . . . . 0.0 110.479 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -84.5 3.07 38.11 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.005 0.522 . . . . 0.0 110.909 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.482 ' CZ ' HD21 ' A' ' 7' ' ' LEU . 30.2 t80 -129.36 68.17 79.81 Favored Pre-proline 0 N--CA 1.454 -0.244 0 C-N-CA 122.408 0.283 . . . . 0.0 110.783 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.03 167.71 24.01 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.827 3.018 . . . . 0.0 110.746 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.2 11.28 11.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.82 7.55 3.05 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.072 0.949 . . . . 0.0 111.558 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 32.6 m -134.92 177.41 6.87 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.777 0.831 . . . . 0.0 109.911 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -59.32 151.23 59.99 Favored Pre-proline 0 N--CA 1.455 -0.22 0 C-N-CA 122.43 0.292 . . . . 0.0 110.291 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -70.64 12.71 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.063 3.176 . . . . 0.0 111.629 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -133.52 -17.61 2.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.438 0.695 . . . . 0.0 111.734 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 41.8 tp -74.45 -31.65 62.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.565 0.621 . . . . 0.0 110.198 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.91 -26.41 64.71 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -67.34 -42.17 83.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -79.87 -32.58 40.41 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.562 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -63.72 -44.81 92.51 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.632 0.651 . . . . 0.0 111.448 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.3 mmm -76.73 -33.4 58.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.01 -176.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -69.88 -33.31 72.07 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.477 177.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -67.53 -29.02 68.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.29 -37.98 71.19 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 49.5 mm -72.21 -38.25 61.71 Favored 'Isoleucine or valine' 0 C--O 1.23 0.074 0 CA-C-N 117.692 0.746 . . . . 0.0 110.267 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -69.52 -33.76 73.28 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.264 -0.272 . . . . 0.0 110.554 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.05 -33.11 73.06 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.106 -0.371 . . . . 0.0 110.262 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.2 t -73.06 -25.71 61.02 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.15 -36.5 61.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.169 0.187 . . . . 0.0 110.594 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -75.64 -23.86 56.38 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.3 -0.25 . . . . 0.0 110.452 176.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -72.6 2.14 6.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.262 0.625 . . . . 0.0 111.869 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -140.11 3.85 2.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.038 0.535 . . . . 0.0 111.001 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 72.19 13.95 76.57 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.82 -0.433 . . . . 0.0 112.524 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -69.14 -6.11 26.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 117.675 0.737 . . . . 0.0 111.454 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.28 159.83 43.2 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.062 -0.399 . . . . 0.0 110.69 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -148.69 -166.67 2.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.973 1.309 . . . . 0.0 108.76 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -57.63 173.23 0.3 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.116 0.566 . . . . 0.0 110.617 174.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.6 p -138.14 171.54 14.25 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.26 0.552 . . . . 0.0 111.996 -173.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -145.5 16.72 1.48 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.713 0.805 . . . . 0.0 110.67 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m 61.77 179.06 0.12 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.465 1.106 . . . . 0.0 112.642 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -141.39 25.78 2.02 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.882 0.473 . . . . 0.0 111.394 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.64 -173.63 2.79 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.714 0.806 . . . . 0.0 109.928 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.8 8.0 3.26 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -173.27 10.29 0.04 OUTLIER Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.643 -0.789 . . . . 0.0 114.446 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.6 t -148.38 9.09 0.83 Allowed 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.52 1.16 . . . . 0.0 112.269 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -154.02 -41.79 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.988 -0.445 . . . . 0.0 109.99 174.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.19 -23.09 64.8 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 121.65 -0.656 . . . . 0.0 109.808 174.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.43 -26.1 38.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 122.446 0.299 . . . . 0.0 110.364 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.64 -3.76 54.33 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.184 0.594 . . . . 0.0 111.845 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -129.75 -13.07 4.24 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.07 -1.92 31.47 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.098 0.559 . . . . 0.0 110.794 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.48 ' C ' HD22 ' A' ' 91' ' ' LEU . 86.6 mtt-85 -126.49 -15.62 5.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.489 0.716 . . . . 0.0 110.594 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.48 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.1 mm? -135.96 38.89 2.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.782 1.233 . . . . 0.0 110.204 -176.028 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.33 2.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -130.42 7.81 4.97 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.916 0.78 . . . . 0.0 112.333 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 tpp -61.86 142.78 57.16 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.014 0.37 . . . . 0.0 110.034 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 m -64.07 137.88 97.24 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.091 0.556 . . . . 0.0 109.665 178.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -68.81 5.5 1.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.905 3.07 . . . . 0.0 113.394 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -127.54 -33.67 2.3 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.5 m -67.84 -24.16 65.24 Favored 'General case' 0 C--N 1.337 0.057 0 O-C-N 121.858 -0.526 . . . . 0.0 109.951 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttm-85 -67.09 -32.52 73.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.671 0.388 . . . . 0.0 110.195 174.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -74.51 -37.48 63.09 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.34 -34.07 75.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 122.184 -0.322 . . . . 0.0 110.285 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.2 tp -65.96 -42.59 89.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.676 0.39 . . . . 0.0 110.947 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.13 -6.68 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.712 -0.617 . . . . 0.0 111.347 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -97.94 -4.9 35.45 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 175.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 69.4 p -134.84 3.37 3.22 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -140.16 10.43 2.35 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.246 0.475 . . . . 0.0 112.084 177.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.435 ' SD ' ' HB3' ' B' ' 32' ' ' LEU . 2.4 mtm -137.49 -8.9 1.69 Allowed 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -150.27 -9.01 0.28 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.012 0.824 . . . . 0.0 112.683 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 69.51 23.07 76.71 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.084 -0.842 . . . . 0.0 113.738 173.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -56.19 150.83 13.5 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.709 1.254 . . . . 0.0 109.98 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.4 m -66.07 155.61 86.75 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.3 -19.62 43.72 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 122.382 2.055 . . . . 0.0 111.357 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -73.57 -33.49 64.68 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.997 -0.439 . . . . 0.0 110.224 176.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -83.4 -37.91 22.65 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.31 0.244 . . . . 0.0 110.434 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.11 -27.4 68.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.213 -0.304 . . . . 0.0 111.03 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.16 -32.07 33.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 117.688 0.222 . . . . 0.0 110.721 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -71.4 -30.55 66.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.134 0.574 . . . . 0.0 110.836 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 58.6 mt -74.14 -5.77 43.72 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 176.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.0 pt -135.38 11.57 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 118.725 0.693 . . . . 0.0 111.289 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 55.06 54.55 8.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.516 1.126 . . . . 0.0 114.016 176.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.9 m -136.06 176.07 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.111 0.564 . . . . 0.0 110.266 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -74.38 157.3 35.93 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 88.4 m -60.97 -36.23 78.86 Favored 'General case' 0 N--CA 1.457 -0.106 0 O-C-N 122.193 -0.317 . . . . 0.0 110.81 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 95.6 p -75.94 -21.17 57.32 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.063 -0.398 . . . . 0.0 111.134 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -74.67 -43.29 55.98 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.087 -0.383 . . . . 0.0 110.413 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.63 -31.5 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 C-N-CA 119.481 -0.888 . . . . 0.0 110.063 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -63.67 -34.11 77.12 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.8 m -77.13 -37.59 53.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.222 -0.299 . . . . 0.0 110.422 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.03 -33.79 76.88 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.383 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.12 -26.86 9.21 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 118.314 0.506 . . . . 0.0 111.096 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.5 m -67.59 -38.5 84.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -78.34 -25.2 46.34 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 122.263 -0.273 . . . . 0.0 110.5 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.72 48.61 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.744 0.247 . . . . 0.0 110.342 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.79 -22.21 63.34 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.084 -0.385 . . . . 0.0 110.968 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.1 -36.41 69.45 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.387 -0.196 . . . . 0.0 110.967 176.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -83.79 -16.8 43.31 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.759 -0.588 . . . . 0.0 111.094 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 9.4 mm -62.24 -52.63 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.53 -17.31 60.76 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.88 -15.6 63.1 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -147.47 -44.4 0.17 Allowed 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 47.6 p . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 118.759 2.874 . . . . 0.0 118.759 -177.204 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 . . . . . 0 CA--C 1.53 0.173 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.6 tpt -63.08 -25.76 68.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.908 0.322 . . . . 0.0 111.46 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.02 58.72 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.71 -16.04 62.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.238 -0.566 . . . . 0.0 111.014 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.12 -39.24 18.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.435 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 63.2 mt -74.43 -38.07 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.937 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -68.26 -33.69 74.83 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.175 -0.44 . . . . 0.0 110.471 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.5 t -66.24 -36.5 83.17 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.665 0.666 . . . . 0.0 110.622 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.65 -32.09 73.47 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.584 0.231 . . . . 0.0 111.014 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -97.96 -11.38 23.14 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 68.7 tp60 -71.36 -36.68 71.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 121.899 -0.501 . . . . 0.0 110.196 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -64.63 -24.35 67.56 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 120.311 -0.555 . . . . 0.0 110.835 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 13.1 m -70.17 -12.62 61.73 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 111.382 0.141 . . . . 0.0 111.382 174.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 67.6 mt -107.16 -18.05 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 O-C-N 121.96 -0.463 . . . . 0.0 110.785 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.51 26.64 0.1 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.575 0.75 . . . . 0.0 112.054 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -142.06 176.5 8.91 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.058 0.543 . . . . 0.0 111.151 -178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -63.35 175.31 1.01 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.865 0.866 . . . . 0.0 111.362 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.94 155.12 80.51 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 122.407 0.283 . . . . 0.0 110.481 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' PRO . . . . . 0.451 ' C ' ' H ' ' B' ' 47' ' ' GLU . 51.5 Cg_exo -54.79 -39.55 89.15 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.681 2.921 . . . . 0.0 114.952 -174.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.8 t70 51.37 -11.18 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.473 1.909 . . . . 0.0 115.286 -174.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.451 ' H ' ' C ' ' B' ' 45' ' ' PRO . 14.1 pt-20 -66.53 -16.51 64.2 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.131 -0.981 . . . . 0.0 111.65 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 29.6 mtm -73.3 -32.25 64.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.274 -0.266 . . . . 0.0 111.044 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -84.24 -12.27 55.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.793 -0.567 . . . . 0.0 110.018 173.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.21 -20.61 62.24 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.837 -0.539 . . . . 0.0 109.649 169.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 75.9 mt -78.55 -13.58 59.76 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.337 0.255 . . . . 0.0 110.406 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -88.13 -16.0 34.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -75.55 6.85 4.22 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.845 0.858 . . . . 0.0 111.675 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -127.66 9.77 6.53 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.732 0.813 . . . . 0.0 111.566 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 pp -145.21 -17.33 0.49 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 120.807 0.337 . . . . 0.0 110.78 173.631 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.9 t . . . . . 0 N--CA 1.456 -0.142 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.3 tp -59.22 -28.57 66.8 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.038 0.535 . . . . 0.0 110.967 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.45 -31.5 80.97 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.938 -0.465 . . . . 0.0 111.938 -178.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -77.17 1.42 18.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 122.719 0.408 . . . . 0.0 111.265 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -133.07 3.57 3.71 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.189 0.595 . . . . 0.0 110.695 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.6 tp -111.69 -41.1 4.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.542 0.337 . . . . 0.0 110.45 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.415 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.16 -45.23 99.88 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 98.9 Cg_endo -74.86 -0.39 9.84 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.431 2.087 . . . . 0.0 112.774 -176.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -135.13 14.04 3.55 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 68.3 mt -54.33 -44.31 98.57 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.574 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -81.47 -10.01 12.25 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.07 1.847 . . . . 0.0 112.672 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.57 -24.52 66.36 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 118.646 0.657 . . . . 0.0 110.621 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.2 mt -67.4 -18.92 65.31 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.67 0.271 . . . . 0.0 110.442 176.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -98.81 -14.65 19.58 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.462 0.705 . . . . 0.0 110.276 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -16.24 53.78 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.438 0.695 . . . . 0.0 111.097 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -141.59 -21.02 0.74 Allowed 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.52 -23.24 77.76 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -71.87 -10.02 59.16 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 117.657 0.729 . . . . 0.0 111.647 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.08 6.1 5.39 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.74 0.416 . . . . 0.0 111.466 -177.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -91.95 -0.96 57.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.098 0.559 . . . . 0.0 110.437 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 t -151.37 -4.95 0.28 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.44 18.08 71.28 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.44 -0.788 . . . . 0.0 114.096 173.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 t -143.81 131.24 21.0 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 118.344 1.072 . . . . 0.0 110.16 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -74.67 -22.94 58.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.181 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.57 -35.53 58.13 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -73.88 -35.77 64.74 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.0 -36.57 86.38 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.64 -35.69 75.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.222 0.511 . . . . 0.0 111.323 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.8 24.07 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.753 -176.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -65.18 -35.98 82.79 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.295 0.952 . . . . 0.0 109.427 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 24.6 t -62.91 -53.52 45.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 C-N-CA 122.338 0.255 . . . . 0.0 110.687 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -71.58 -28.12 63.61 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.43 -175.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.02 -21.59 59.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 122.201 0.2 . . . . 0.0 110.748 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 m -66.37 -44.88 81.92 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -38.1 64.2 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.964 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -67.32 -14.56 63.03 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.803 -0.561 . . . . 0.0 110.923 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.4 0.4 56.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.324 0.65 . . . . 0.0 111.216 174.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 88.3 mt -123.57 -14.27 5.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 123.523 0.729 . . . . 0.0 111.358 -174.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -60.07 -4.79 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 121.503 -0.748 . . . . 0.0 112.964 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.3 2.1 8.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.024 0.53 . . . . 0.0 111.143 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.32 54.74 0.86 Allowed Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 123.651 0.781 . . . . 0.0 110.544 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.7 -13.04 36.83 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 123.435 2.757 . . . . 0.0 113.049 -174.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -74.99 -14.97 60.68 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.463 0.305 . . . . 0.0 111.213 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -77.74 -19.79 54.56 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.007 -0.433 . . . . 0.0 111.016 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.46 114.55 52.33 Favored Pre-proline 0 N--CA 1.452 -0.345 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.87 155.09 71.12 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.526 2.151 . . . . 0.0 110.986 -176.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -136.8 12.85 3.15 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.771 0.828 . . . . 0.0 110.772 -174.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -134.73 27.93 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.343 0.657 . . . . 0.0 111.041 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.6 m -134.76 179.15 4.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 123.828 0.851 . . . . 0.0 109.207 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -54.43 146.72 31.79 Favored Pre-proline 0 CA--C 1.531 0.212 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -70.79 9.71 0.73 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.826 3.017 . . . . 0.0 111.722 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -129.37 -16.88 3.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.5 0.72 . . . . 0.0 110.933 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.8 tp -78.84 -34.17 45.37 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.165 0.439 . . . . 0.0 110.303 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.64 -31.28 60.79 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.54 -47.67 77.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -74.75 -30.0 61.34 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 119.698 -0.191 . . . . 0.0 111.485 -177.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -63.05 -45.91 89.99 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 118.382 0.537 . . . . 0.0 110.605 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 92.9 mmm -73.54 -31.3 63.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.829 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.37 -37.9 74.65 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.036 0.38 . . . . 0.0 111.016 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -65.71 -24.82 67.07 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.29 -37.22 63.24 Favored Glycine 0 C--N 1.339 0.721 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.5 mm -73.19 -39.93 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 CA-C-N 117.709 0.755 . . . . 0.0 110.432 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -68.27 -33.64 74.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.293 -0.254 . . . . 0.0 111.122 -177.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.32 -31.54 68.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 117.78 0.264 . . . . 0.0 110.433 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.2 t -75.97 -26.1 56.46 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.146 0.178 . . . . 0.0 110.835 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.58 -36.79 68.26 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.382 0.273 . . . . 0.0 110.991 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -77.15 -22.81 52.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.55 3.64 18.21 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.259 0.624 . . . . 0.0 111.747 177.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -138.86 2.91 2.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.846 0.458 . . . . 0.0 111.242 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.43 26.62 72.95 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 119.684 -0.509 . . . . 0.0 113.133 175.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.63 -10.15 17.3 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.164 0.982 . . . . 0.0 112.249 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.65 158.5 38.42 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.057 0.543 . . . . 0.0 110.363 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -144.52 5.73 1.23 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.344 0.657 . . . . 0.0 110.769 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.0 t -156.69 178.09 10.73 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.071 0.548 . . . . 0.0 109.956 -177.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.5 p -145.43 17.24 1.51 Allowed 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.528 0.731 . . . . 0.0 110.619 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -56.42 150.32 15.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.11 0.564 . . . . 0.0 110.278 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -144.84 -176.27 5.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.22 0.608 . . . . 0.0 109.855 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -141.21 13.12 2.2 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.782 0.433 . . . . 0.0 111.697 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.82 156.92 13.2 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.062 -0.398 . . . . 0.0 110.835 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.42 -11.94 59.91 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -175.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 156.19 26.04 0.03 OUTLIER Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.305 -0.719 . . . . 0.0 113.787 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.7 t -138.05 13.48 2.86 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.602 1.201 . . . . 0.0 112.111 -177.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -155.16 -50.04 0.09 Allowed 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -20.75 64.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.477 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.56 -29.96 47.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 122.465 0.306 . . . . 0.0 110.828 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.23 -2.05 54.63 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.822 0.449 . . . . 0.0 111.564 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -116.04 -44.62 2.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.58 0.352 . . . . 0.0 110.776 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.7 -1.61 1.99 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.468 ' C ' HD22 ' A' ' 91' ' ' LEU . 82.6 mtt-85 -120.82 -15.38 8.36 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.424 0.69 . . . . 0.0 111.516 178.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.468 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.1 mm? -134.32 28.23 3.73 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.909 0.884 . . . . 0.0 110.626 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.88 1.07 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -130.85 0.29 4.29 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.641 0.655 . . . . 0.0 112.097 -175.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.7 ttm -59.14 152.02 21.35 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.6 m -53.46 137.76 50.69 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 123.172 0.589 . . . . 0.0 110.548 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.95 -5.43 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 125.083 3.855 . . . . 0.0 115.9 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 21.7 tp -133.57 -23.49 1.84 Allowed 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 111.898 -178.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 48.2 m -68.74 -24.7 64.49 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.639 0.654 . . . . 0.0 109.878 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 69.3 ttt-85 -73.07 -27.78 61.93 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -78.27 -35.24 48.35 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.84 74.59 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.3 tp -65.76 -49.78 67.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.395 0.278 . . . . 0.0 110.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.26 -4.55 33.81 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 115' ' ' ALA . 19.1 tp -106.15 -4.59 20.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.09 0.556 . . . . 0.0 111.72 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 77.3 p -140.06 3.28 1.98 Allowed 'General case' 0 C--N 1.34 0.189 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.52 6.2 4.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.324 0.511 . . . . 0.0 112.147 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 1.4 mtm -127.38 -7.7 5.81 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.927 0.491 . . . . 0.0 111.887 176.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -150.65 -22.9 0.23 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.744 0.702 . . . . 0.0 112.103 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 79.05 28.05 54.87 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.218 -0.768 . . . . 0.0 113.426 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -51.25 149.22 4.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.275 1.037 . . . . 0.0 110.659 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.0 m -62.16 152.54 77.99 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.78 -17.02 37.73 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.996 2.464 . . . . 0.0 111.945 -176.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -78.98 -41.34 29.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.029 0.377 . . . . 0.0 110.368 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -78.7 -30.51 46.05 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.425 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -68.49 -25.36 64.93 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 175.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.05 -27.75 35.61 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.125 0.17 . . . . 0.0 110.757 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -70.45 -33.42 71.27 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.036 0.535 . . . . 0.0 111.628 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 77.7 mt -74.02 -4.29 34.46 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.411 HG13 HG22 ' A' ' 121' ' ' VAL . 28.6 pt -135.92 9.22 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 118.306 0.503 . . . . 0.0 110.978 177.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 50.08 61.04 3.39 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.136 1.374 . . . . 0.0 113.935 178.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 119' ' ' ILE . 22.3 m -134.69 -175.51 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 C-N-CA 123.854 0.862 . . . . 0.0 109.792 175.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -89.65 159.66 17.02 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -56.51 -39.11 72.75 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 122.565 0.346 . . . . 0.0 111.416 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.2 m -70.82 -20.57 62.55 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.868 0.467 . . . . 0.0 112.034 -177.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -73.98 -40.7 62.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.5 t -63.45 -38.22 81.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.12 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -60.56 -38.44 84.55 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.48 0.181 . . . . 0.0 110.856 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.3 m -76.12 -37.71 57.75 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.905 -0.134 . . . . 0.0 110.772 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.82 -34.09 77.04 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.415 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 m -81.34 -28.44 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 CA-C-N 118.452 0.569 . . . . 0.0 111.028 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 55.4 m -66.22 -40.52 90.36 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.49 -28.16 56.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.4 -44.11 65.56 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.344 -0.222 . . . . 0.0 111.246 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.61 -22.83 59.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 O-C-N 122.15 -0.344 . . . . 0.0 111.026 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.17 -42.63 72.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.611 0.187 . . . . 0.0 110.935 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -77.75 -17.8 57.17 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.151 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.5 mm -73.94 -53.93 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 173.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.43 -17.12 63.62 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -173.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -85.69 -10.84 55.06 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -156.69 -36.35 0.08 Allowed 'General case' 0 C--N 1.339 0.145 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 43.0 p . . . . . 0 N--CA 1.468 0.463 0 C-N-CA 124.341 1.056 . . . . 0.0 112.852 -169.728 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 111.013 0.005 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.61 -26.91 62.23 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.098 0.559 . . . . 0.0 112.269 -175.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.93 -42.52 96.84 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.32 -20.44 62.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 122.507 -0.408 . . . . 0.0 110.772 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.59 -36.53 70.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.74 -37.43 67.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -66.48 -32.63 74.11 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.563 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 57.8 m -66.6 -42.11 87.44 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.651 0.659 . . . . 0.0 110.74 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -24.5 64.95 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -107.73 -13.63 14.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -175.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -68.66 -31.26 70.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 170.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -57.5 -37.07 72.37 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 175.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.4 m -68.41 -12.58 61.36 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 46.6 mm -105.9 -16.02 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.803 -0.561 . . . . 0.0 111.259 -178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.92 28.62 0.17 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.252 0.621 . . . . 0.0 110.646 175.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -134.32 173.66 11.38 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.225 0.61 . . . . 0.0 111.309 -174.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -69.12 179.01 2.05 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.023 0.929 . . . . 0.0 110.89 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.4 m -136.82 155.01 76.73 Favored Pre-proline 0 C--O 1.233 0.234 0 C-N-CA 123.376 0.67 . . . . 0.0 110.41 -178.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -77.25 178.74 7.26 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.691 2.927 . . . . 0.0 110.531 176.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -145.99 -0.44 0.8 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.985 0.514 . . . . 0.0 110.929 175.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.15 -24.64 67.46 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 122.912 0.485 . . . . 0.0 112.242 -177.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 53.4 mtm -74.81 -32.78 62.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 122.225 -0.297 . . . . 0.0 110.788 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.71 -12.65 55.56 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.28 -20.44 61.51 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 69.9 mt -71.0 -18.35 62.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.181 -0.324 . . . . 0.0 110.337 172.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 18.5 mt -84.94 -19.15 32.63 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.728 173.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -73.14 8.19 1.76 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.932 0.333 . . . . 0.0 111.039 176.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -130.37 12.96 5.54 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.813 0.845 . . . . 0.0 109.986 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.1 mt -131.47 -26.36 2.06 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 123.568 0.747 . . . . 0.0 111.784 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.274 0 CA-C-N 118.016 0.371 . . . . 0.0 110.511 171.17 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.8 p . . . . . 0 CA--C 1.531 0.213 0 CA-C-O 120.805 0.336 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.2 tp -56.72 -33.36 66.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.669 0.788 . . . . 0.0 111.901 -178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.61 -35.08 91.5 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 121.69 -0.631 . . . . 0.0 112.051 -176.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -74.33 3.17 7.77 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.747 0.819 . . . . 0.0 110.94 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.3 mm-40 -131.81 -1.93 3.74 Favored 'General case' 0 N--CA 1.458 -0.059 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 tt -111.37 -43.05 3.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.125 0.57 . . . . 0.0 110.624 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.42 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -54.57 -45.2 99.53 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -175.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 83.9 Cg_endo -75.04 2.26 6.85 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.264 1.976 . . . . 0.0 113.16 -176.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -130.85 9.92 5.0 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.777 0.431 . . . . 0.0 112.02 -177.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -56.6 -42.35 95.83 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.81 -7.53 14.48 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.922 1.748 . . . . 0.0 112.58 -173.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -71.61 -19.86 62.06 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.542 0.61 . . . . 0.0 111.945 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.402 HD12 ' N ' ' A' ' 14' ' ' LEU . 8.8 mp -77.18 -23.36 51.54 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.815 -0.553 . . . . 0.0 110.886 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -101.78 -15.56 16.9 Favored 'General case' 0 C--O 1.228 -0.027 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -52.48 -27.66 17.15 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.711 1.205 . . . . 0.0 110.884 175.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -137.42 -13.54 1.54 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.568 0.347 . . . . 0.0 111.241 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.44 -34.95 87.51 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 47.2 tpt85 -65.44 -20.88 66.55 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.1 0.95 . . . . 0.0 111.369 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.92 -3.6 55.76 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.824 0.45 . . . . 0.0 110.906 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mp -111.56 7.77 20.72 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.956 0.902 . . . . 0.0 111.141 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.1 p -140.46 -22.43 0.82 Allowed 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.43 8.73 60.04 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-O 119.558 -0.579 . . . . 0.0 112.673 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.5 t -154.51 138.12 16.04 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.331 1.065 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -72.5 -23.19 60.99 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.438 -0.164 . . . . 0.0 110.821 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -70.33 -39.06 74.96 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.314 -0.241 . . . . 0.0 110.562 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -82.2 -32.07 30.04 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.07 -43.55 90.27 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -72.5 -29.4 63.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 117.341 0.57 . . . . 0.0 110.817 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 tmmm? -70.7 -44.04 67.77 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.882 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -64.67 -31.9 73.33 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.129 0.422 . . . . 0.0 110.91 179.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.4 t -62.08 -52.75 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 117.995 0.361 . . . . 0.0 110.935 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -76.59 -26.77 55.38 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.358 -176.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.38 -24.98 61.34 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.284 0.234 . . . . 0.0 110.503 176.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 66.3 m -65.98 -40.15 90.96 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 175.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 -46.64 65.6 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -59.62 -25.32 64.56 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.902 0.481 . . . . 0.0 111.695 -178.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.88 1.0 32.69 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.132 0.573 . . . . 0.0 111.617 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.4 mt -123.8 -16.01 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 123.766 0.826 . . . . 0.0 110.561 -176.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.5 t -59.59 -13.92 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.181 0.592 . . . . 0.0 111.641 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 3.74 9.67 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.063 0.545 . . . . 0.0 111.298 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.31 55.73 1.23 Allowed Pre-proline 0 N--CA 1.452 -0.346 0 C-N-CA 122.935 0.494 . . . . 0.0 110.608 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.45 -8.84 20.21 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.109 2.54 . . . . 0.0 112.173 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -78.7 -6.66 56.38 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.903 0.481 . . . . 0.0 110.791 174.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -99.49 8.51 44.46 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.511 0.725 . . . . 0.0 110.774 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.415 ' N ' ' HD3' ' A' ' 47' ' ' PRO . 6.3 t80 -134.23 62.06 53.98 Favored Pre-proline 0 CA--C 1.533 0.317 0 C-N-CA 123.064 0.546 . . . . 0.0 109.976 -178.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.415 ' HD3' ' N ' ' A' ' 46' ' ' PHE . 54.4 Cg_exo -52.78 163.69 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.701 3.601 . . . . 0.0 114.849 -175.188 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.401 ' HD3' ' C ' ' A' ' 47' ' ' PRO . 0.5 OUTLIER -121.41 8.99 10.24 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.49 1.116 . . . . 0.0 109.506 177.287 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -76.08 5.25 6.98 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.168 0.987 . . . . 0.0 111.891 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.3 m -136.68 -179.2 2.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.991 0.916 . . . . 0.0 109.347 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.485 ' C ' ' H ' ' A' ' 53' ' ' ARG . 1.8 m-20 -54.46 147.03 30.69 Favored Pre-proline 0 N--CA 1.455 -0.219 0 O-C-N 122.388 -0.195 . . . . 0.0 110.546 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -71.44 18.54 0.27 Allowed 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 124.148 3.232 . . . . 0.0 110.528 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 51' ' ' ASP . 86.6 mtm180 -131.51 -30.38 1.68 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.001 0.92 . . . . 0.0 110.99 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 62.1 tp -72.01 -39.42 69.22 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.682 0.219 . . . . 0.0 110.588 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.68 -29.83 62.84 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.68 -40.9 97.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.63 0.372 . . . . 0.0 110.075 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.54 -27.67 41.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -68.56 -41.45 79.73 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.358 -0.214 . . . . 0.0 110.838 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 98.4 mmm -81.71 -31.24 32.2 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.796 -0.145 . . . . 0.0 110.888 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.4 -37.39 83.04 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -71.87 -24.26 61.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.54 -37.69 93.94 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.8 mm -73.78 -35.47 43.49 Favored 'Isoleucine or valine' 0 C--N 1.338 0.104 0 CA-C-N 117.892 0.846 . . . . 0.0 109.882 176.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -65.9 -37.41 86.03 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.92 -30.27 67.64 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.305 -0.247 . . . . 0.0 110.832 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.3 t -74.89 -28.83 60.79 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 110.618 -0.141 . . . . 0.0 110.618 178.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.54 -31.11 65.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.097 -0.377 . . . . 0.0 110.709 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -83.01 -12.55 57.16 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.539 0.336 . . . . 0.0 110.705 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.9 5.84 49.91 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.351 0.66 . . . . 0.0 111.124 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -137.53 0.48 2.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.005 0.522 . . . . 0.0 111.133 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.67 6.21 89.11 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.732 -0.482 . . . . 0.0 113.323 176.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -66.49 -20.0 65.93 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.985 0.892 . . . . 0.0 110.621 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.99 153.11 29.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.818 0.847 . . . . 0.0 109.688 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -147.61 -0.59 0.64 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.735 0.414 . . . . 0.0 111.958 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.5 t -160.61 175.47 12.64 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.155 0.434 . . . . 0.0 110.436 -177.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.4 p -153.0 159.82 42.95 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.489 0.715 . . . . 0.0 110.121 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -160.91 177.03 10.78 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.277 0.631 . . . . 0.0 109.482 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.0 m -141.64 155.43 45.71 Favored 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 123.296 0.638 . . . . 0.0 109.314 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -152.09 14.04 0.61 Allowed 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -173.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.56 165.97 2.66 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.057 0.456 . . . . 0.0 111.223 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.37 -10.88 55.46 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.52 21.23 0.03 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.949 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.7 t -137.11 6.44 2.85 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.715 1.257 . . . . 0.0 112.742 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -143.92 -36.01 0.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.02 -25.63 66.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.6 -24.56 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 122.567 0.347 . . . . 0.0 110.517 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.06 -1.4 56.79 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.859 0.463 . . . . 0.0 111.814 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -130.41 -16.07 3.53 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 117.804 0.275 . . . . 0.0 111.625 175.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.07 -1.54 32.89 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.771 0.259 . . . . 0.0 110.566 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -130.55 -8.54 4.11 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.585 0.754 . . . . 0.0 112.034 -177.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.8 mt -139.58 12.9 2.53 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -170.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.54 5.45 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -130.29 3.73 4.73 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 119.12 0.873 . . . . 0.0 112.642 -173.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 52.9 ttm -67.09 158.99 29.77 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 98.0 m -59.01 138.08 87.71 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 122.89 0.476 . . . . 0.0 109.944 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 75.5 Cg_exo -52.0 -7.87 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 125.19 3.927 . . . . 0.0 116.335 -178.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.1 tp -131.73 -22.29 2.4 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 119.002 0.819 . . . . 0.0 111.814 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.4 m -66.99 -19.18 65.67 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.929 -0.482 . . . . 0.0 110.059 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -65.87 -34.13 77.43 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.649 0.38 . . . . 0.0 110.25 175.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -80.7 -34.69 34.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.27 -32.38 74.01 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.966 -0.459 . . . . 0.0 109.794 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.71 -46.14 73.08 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.004 0.522 . . . . 0.0 110.78 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -74.94 -6.65 50.37 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.353 0.524 . . . . 0.0 111.445 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 74.9 mt -99.79 -6.29 27.19 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.767 0.427 . . . . 0.0 112.0 176.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -135.08 4.72 3.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.488 0.585 . . . . 0.0 112.551 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.96 7.93 1.86 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.49 0.316 . . . . 0.0 111.383 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.404 ' SD ' ' HB3' ' B' ' 32' ' ' LEU . 3.1 mtm -141.98 1.83 1.49 Allowed 'General case' 0 C--N 1.338 0.087 0 C-N-CA 123.487 0.715 . . . . 0.0 111.87 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -149.43 -17.93 0.28 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.628 0.649 . . . . 0.0 112.187 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 72.51 10.85 76.15 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 119.282 -0.732 . . . . 0.0 113.401 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -59.73 148.21 35.02 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.819 1.309 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.2 m -70.06 152.51 95.8 Favored Pre-proline 0 N--CA 1.452 -0.333 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.29 -24.08 25.75 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.208 2.605 . . . . 0.0 113.206 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.05 -34.6 66.39 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.611 0.364 . . . . 0.0 111.343 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -79.68 -38.28 33.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.87 -24.68 65.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.729 -0.177 . . . . 0.0 111.124 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.4 -39.11 65.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.958 0.345 . . . . 0.0 110.507 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -67.38 -26.11 66.3 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.597 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 18.4 tp -83.47 -6.2 59.39 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -176.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.411 HG13 HG22 ' A' ' 121' ' ' VAL . 15.7 pt -135.46 11.99 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.645 0.657 . . . . 0.0 111.435 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 56.81 53.71 7.95 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.186 0.994 . . . . 0.0 113.524 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 119' ' ' ILE . 28.2 m -136.38 178.61 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 123.443 0.697 . . . . 0.0 110.058 176.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -80.44 157.67 26.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 46.5 m -60.35 -34.4 73.79 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.9 -0.5 . . . . 0.0 110.818 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 84.0 p -72.28 -21.36 61.37 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 122.377 -0.202 . . . . 0.0 111.46 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -74.39 -36.36 63.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.2 t -64.05 -37.69 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.71 -33.23 73.65 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.2 m -77.31 -38.28 50.89 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 122.341 -0.224 . . . . 0.0 110.795 177.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.2 -35.61 80.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.128 0.422 . . . . 0.0 111.429 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.5 m -76.42 -27.65 17.54 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 118.805 0.73 . . . . 0.0 110.716 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.3 m -67.43 -35.76 79.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -81.15 -25.06 37.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.77 -47.34 66.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.51 -22.43 61.79 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.818 -0.135 . . . . 0.0 110.966 179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.51 -36.7 68.42 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -72.85 -25.11 60.99 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 117.668 0.213 . . . . 0.0 110.605 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 20.2 mm -72.83 -54.62 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -61.54 -21.68 64.48 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.614 0.366 . . . . 0.0 111.685 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -72.23 -24.58 61.41 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -177.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -154.46 -53.52 0.1 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -169.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 22.7 p . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -171.309 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 . . . . . 0 CA--C 1.532 0.265 0 N-CA-C 111.44 0.163 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.6 tpt -55.03 -26.76 39.49 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.925 0.49 . . . . 0.0 112.166 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.25 -40.62 60.8 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.74 -20.3 62.65 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.565 -0.374 . . . . 0.0 110.514 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.4 -37.36 63.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.404 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 42.0 mt -77.5 -40.13 43.92 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.521 0.328 . . . . 0.0 110.302 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.46 -34.35 77.73 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.203 -0.311 . . . . 0.0 110.747 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 44.2 t -71.59 -37.36 70.99 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.092 0.405 . . . . 0.0 110.851 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.43 -23.87 65.58 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.247 0.219 . . . . 0.0 110.968 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -104.81 -11.75 16.63 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.146 -0.346 . . . . 0.0 111.289 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.0 -36.27 82.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -62.32 -35.76 80.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.654 0.381 . . . . 0.0 110.816 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 56.3 m -66.41 -11.82 53.72 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.548 0.574 . . . . 0.0 112.548 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 35.3 pt -129.4 13.16 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.926 -0.484 . . . . 0.0 111.545 -176.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.72 23.53 0.13 Allowed 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.599 0.76 . . . . 0.0 112.188 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.08 -178.53 5.75 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.753 -0.592 . . . . 0.0 111.826 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -63.74 -177.62 0.25 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.386 1.074 . . . . 0.0 112.503 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -134.3 156.62 78.81 Favored Pre-proline 0 CA--C 1.53 0.175 0 C-N-CA 123.466 0.707 . . . . 0.0 110.276 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.7 178.97 6.7 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 123.1 2.533 . . . . 0.0 110.622 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -146.47 -0.43 0.75 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.291 0.236 . . . . 0.0 111.456 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -63.01 -24.53 67.96 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.165 -0.334 . . . . 0.0 111.709 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.1 mtm -72.85 -29.8 63.49 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.217 0.207 . . . . 0.0 111.328 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.5 -14.37 43.28 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.1 -20.48 61.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.33 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.499 ' C ' ' H ' ' B' ' 54' ' ' LYS . 22.1 mt -76.69 -15.42 59.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 119.679 -0.201 . . . . 0.0 111.099 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -69.02 16.7 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.331 0.514 . . . . 0.0 111.13 173.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.499 ' H ' ' C ' ' B' ' 52' ' ' LEU . 53.7 mtmt -117.2 -3.77 11.47 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.456 1.102 . . . . 0.0 111.219 176.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -157.58 0.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.212 0 C-N-CA 123.281 0.632 . . . . 0.0 111.529 -179.385 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.5 m . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 42.3 tp -62.54 -27.27 69.05 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.111 -0.368 . . . . 0.0 110.687 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.46 -18.93 79.97 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-O 119.685 -0.508 . . . . 0.0 112.333 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -74.61 -2.31 25.44 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 117.984 0.892 . . . . 0.0 111.636 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -134.31 -21.37 1.82 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.18 0.592 . . . . 0.0 111.233 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.4 tp -75.59 -37.44 59.84 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.151 -0.343 . . . . 0.0 110.879 175.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.417 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -56.18 -46.75 99.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -173.067 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 87.7 Cg_endo -73.0 -3.47 13.69 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.523 2.149 . . . . 0.0 112.968 -177.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -129.22 11.11 5.89 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.311 0.505 . . . . 0.0 111.932 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.62 -46.26 99.85 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.21 -9.58 12.67 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 121.995 1.796 . . . . 0.0 112.427 -171.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.5 -32.52 73.45 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.505 0.593 . . . . 0.0 110.651 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.3 -18.22 61.81 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 122.368 -0.207 . . . . 0.0 111.047 -177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.6 mtm180 -98.88 -20.52 16.78 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.029 0.377 . . . . 0.0 110.773 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -61.42 -22.38 64.95 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 117.781 0.264 . . . . 0.0 110.74 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -130.34 -13.74 3.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.768 0.427 . . . . 0.0 110.876 175.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.19 73.82 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -68.17 -19.83 64.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 117.642 0.721 . . . . 0.0 111.052 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -100.93 4.3 42.47 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.623 0.769 . . . . 0.0 112.28 -175.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 59.9 mt -110.23 5.89 22.16 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.4 t -154.18 -20.43 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.964 0.802 . . . . 0.0 113.133 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.64 2.95 53.03 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 118.892 0.769 . . . . 0.0 114.225 174.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -154.82 146.31 23.11 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.658 1.229 . . . . 0.0 111.235 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -77.64 -17.92 57.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.926 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -70.92 -31.02 67.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -82.73 -32.57 27.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.798 0.439 . . . . 0.0 110.398 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.23 -39.94 81.99 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.33 -28.39 61.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.321 0.561 . . . . 0.0 110.4 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -69.26 -42.85 75.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.63 -42.14 95.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.217 -0.42 . . . . 0.0 111.656 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.7 m -67.64 -39.78 82.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.13 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -77.15 -29.26 54.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.515 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.03 -27.12 61.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.1 m -65.64 -40.48 92.56 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -40.92 26.26 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 121.082 -0.247 . . . . 0.0 111.068 -175.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -65.19 -24.65 67.43 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.221 -178.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.54 -1.16 23.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.267 0.627 . . . . 0.0 111.516 175.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 82.0 mt -118.14 -15.72 8.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.006 0.922 . . . . 0.0 109.763 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.18 -9.88 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.388 0.675 . . . . 0.0 111.333 175.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.2 -0.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.393 0.677 . . . . 0.0 110.898 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.21 57.51 1.49 Allowed Pre-proline 0 N--CA 1.452 -0.364 0 C-N-CA 123.29 0.636 . . . . 0.0 110.941 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -65.12 -11.0 27.85 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.086 2.524 . . . . 0.0 112.237 -177.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.17 -17.63 62.53 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.575 0.35 . . . . 0.0 110.653 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -83.3 0.8 44.13 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.999 0.52 . . . . 0.0 111.197 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -132.61 69.34 79.64 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.63 177.93 5.0 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 125.014 3.809 . . . . 0.0 112.197 -173.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 43.0 mmm-85 -123.56 7.09 8.89 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.727 0.811 . . . . 0.0 109.999 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -78.67 10.56 3.15 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.375 1.07 . . . . 0.0 111.844 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.47 171.85 16.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 C-N-CA 123.64 0.776 . . . . 0.0 109.843 -179.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.96 152.01 52.35 Favored Pre-proline 0 N--CA 1.453 -0.28 0 C-N-CA 122.605 0.362 . . . . 0.0 110.495 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -71.38 12.94 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.171 3.248 . . . . 0.0 111.749 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 28.5 mtp180 -131.6 -25.43 2.13 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.321 0.649 . . . . 0.0 110.856 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.3 tp -74.73 -35.94 62.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.38 -28.24 64.17 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.47 -46.01 88.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.14 0.576 . . . . 0.0 110.144 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -80.15 -27.01 39.12 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -65.31 -43.88 89.67 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 118.101 0.41 . . . . 0.0 111.179 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.9 mmm -74.4 -32.76 62.81 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.363 -178.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.6 -36.49 78.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.264 -0.273 . . . . 0.0 110.486 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.89 -26.17 66.75 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.782 0.433 . . . . 0.0 110.133 177.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.42 -39.89 69.18 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -74.19 -34.52 37.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.075 0 CA-C-N 117.794 0.797 . . . . 0.0 110.238 177.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -66.25 -33.02 74.8 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.438 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.41 -33.03 69.09 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 122.146 -0.347 . . . . 0.0 110.454 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -70.83 -25.92 63.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.5 -34.11 47.65 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.193 0.197 . . . . 0.0 110.717 177.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -71.94 -24.32 61.6 Favored 'General case' 0 C--N 1.34 0.178 0 O-C-N 122.14 -0.35 . . . . 0.0 110.336 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.22 0.58 18.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.194 0.598 . . . . 0.0 111.584 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -133.55 -1.03 3.16 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.092 0.557 . . . . 0.0 111.457 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.07 -4.72 83.16 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 122.145 -0.347 . . . . 0.0 112.957 177.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -74.07 -6.3 46.71 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -175.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.37 22.99 1.17 Allowed 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -78.83 4.2 14.67 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.123 -0.361 . . . . 0.0 111.214 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 8.9 t -152.46 168.11 26.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.774 0.83 . . . . 0.0 109.411 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.5 t -156.02 169.94 23.31 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 110.844 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -158.55 167.62 29.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.392 1.077 . . . . 0.0 108.821 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -69.55 170.07 11.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.276 0.56 . . . . 0.0 110.562 173.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -141.78 23.5 2.09 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.65 0.78 . . . . 0.0 108.967 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.73 -174.16 4.62 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.572 1.149 . . . . 0.0 109.577 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.73 11.57 5.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.068 0.547 . . . . 0.0 110.982 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.25 12.37 0.05 OUTLIER Glycine 0 CA--C 1.53 0.995 0 CA-C-O 119.193 -0.782 . . . . 0.0 113.122 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.2 p -138.4 -15.78 1.23 Allowed 'General case' 0 C--N 1.34 0.165 0 CA-C-N 118.373 1.087 . . . . 0.0 113.051 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -137.45 -30.84 0.83 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.12 -29.41 70.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 172.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.27 -35.65 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 122.521 0.329 . . . . 0.0 110.179 177.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.27 0.8 54.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.747 0.819 . . . . 0.0 112.319 -174.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.7 ppt_? -129.51 -18.84 3.49 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.201 0.455 . . . . 0.0 111.966 176.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.47 -14.54 61.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.047 0.385 . . . . 0.0 111.182 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -130.41 5.28 4.77 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.7 mt -138.68 18.8 2.69 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.172 0.589 . . . . 0.0 112.272 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.29 4.87 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -130.1 8.31 5.16 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.801 0.728 . . . . 0.0 111.845 -178.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 60.0 tpp -63.62 150.94 43.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.414 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 85.4 m -64.12 139.96 97.79 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 77.8 Cg_exo -52.73 -3.64 0.12 Allowed 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 124.739 3.626 . . . . 0.0 115.937 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -135.11 -24.98 1.4 Allowed 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.317 0.962 . . . . 0.0 112.285 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 90.4 p -69.38 -21.96 63.75 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.061 0.846 . . . . 0.0 109.432 174.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -68.09 -36.83 80.44 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -74.12 -36.14 64.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.34 73.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.736 -0.173 . . . . 0.0 110.81 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 46.8 tp -64.51 -46.91 80.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 6.2 mp -72.87 -11.35 60.56 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.239 -0.288 . . . . 0.0 111.178 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.0 tp -97.62 -7.37 31.22 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 p -140.59 0.67 1.66 Allowed 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.63 0.96 6.82 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.719 0.69 . . . . 0.0 111.575 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 5.7 ptp -156.29 21.84 0.36 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 177.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -146.27 -23.65 0.44 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.941 0.337 . . . . 0.0 111.798 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.03 8.55 83.21 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 118.797 -1.002 . . . . 0.0 114.728 170.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.21 145.95 49.4 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.336 1.568 . . . . 0.0 110.439 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 52.1 m -71.16 152.6 94.6 Favored Pre-proline 0 N--CA 1.455 -0.225 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.76 -27.16 32.94 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.621 2.881 . . . . 0.0 113.945 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -79.37 -39.07 33.47 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 118.061 0.392 . . . . 0.0 111.288 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -78.32 -31.22 48.68 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.27 -26.0 64.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.386 0.274 . . . . 0.0 111.063 176.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.56 -33.33 41.89 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 122.386 0.274 . . . . 0.0 110.595 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -70.29 -27.17 64.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.63 0.372 . . . . 0.0 110.764 177.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 19.7 tp -76.68 -8.44 57.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.427 HG13 HG22 ' A' ' 121' ' ' VAL . 23.0 pt -136.08 13.17 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.23 0.468 . . . . 0.0 111.609 178.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.93 55.93 7.21 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.427 HG22 HG13 ' A' ' 119' ' ' ILE . 22.4 m -136.32 179.89 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 C-N-CA 123.114 0.565 . . . . 0.0 110.313 175.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -82.63 159.76 22.61 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 176.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.5 m -57.53 -40.22 78.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 122.007 -0.433 . . . . 0.0 110.89 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -72.51 -20.81 61.29 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.655 0.382 . . . . 0.0 111.849 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -72.53 -36.7 68.36 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.635 -0.666 . . . . 0.0 109.97 176.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.24 -38.45 82.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.19 -32.86 73.55 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.56 0.164 . . . . 0.0 110.726 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.4 m -78.45 -39.37 38.79 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.43 -0.169 . . . . 0.0 110.751 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -65.34 -32.38 74.0 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 119.333 -0.365 . . . . 0.0 111.6 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.3 m -82.8 -29.17 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 CA-C-N 118.586 0.63 . . . . 0.0 110.912 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 50.9 m -67.42 -38.36 84.47 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -78.5 -27.17 46.08 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.347 -0.221 . . . . 0.0 110.658 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.37 67.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 117.833 0.288 . . . . 0.0 110.769 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.52 -22.37 57.16 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.193 -0.317 . . . . 0.0 111.232 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.66 -38.11 67.74 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.71 -26.24 61.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.351 -0.218 . . . . 0.0 110.489 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 15.3 mm -74.2 -51.18 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.14 -23.06 66.41 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -84.13 -10.74 57.54 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -153.67 -54.44 0.11 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -177.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 N--CA 1.469 0.503 0 C-N-CA 125.872 1.669 . . . . 0.0 114.982 -166.62 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p30 . . . . . 0 CA--C 1.53 0.185 0 N-CA-C 111.479 0.178 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -62.26 -26.8 68.59 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 118.034 0.379 . . . . 0.0 111.656 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.57 -36.18 58.89 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.79 -24.47 58.66 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.968 0.384 . . . . 0.0 110.813 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.86 -45.48 70.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 84.2 mt -76.49 -36.46 57.82 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.598 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -65.5 -42.46 92.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -64.01 -42.05 97.26 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.355 0.525 . . . . 0.0 111.028 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.13 -29.39 70.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.561 0.219 . . . . 0.0 111.463 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -102.86 -12.49 17.51 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.125 -0.359 . . . . 0.0 111.331 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' GLN . . . . . 0.491 HE21 ' CG ' ' B' ' 41' ' ' GLU . 62.9 tp60 -69.16 -34.11 74.46 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 175.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -73.89 -24.71 59.75 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 121.068 -0.253 . . . . 0.0 110.937 176.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 26.6 m -73.14 -12.14 60.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 27.2 pt -123.25 18.02 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.097 0 O-C-N 121.814 -0.554 . . . . 0.0 112.464 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' GLU . . . . . 0.491 ' CG ' HE21 ' B' ' 37' ' ' GLN . 74.0 mm-40 -132.85 25.29 4.32 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -177.116 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.42 -15.77 0.84 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -166.41 158.8 14.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.179 0.9 . . . . 0.0 111.451 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.84 150.49 59.89 Favored Pre-proline 0 C--O 1.233 0.185 0 C-N-CA 124.318 1.047 . . . . 0.0 108.536 171.16 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' PRO . . . . . 0.404 ' C ' ' H ' ' B' ' 47' ' ' GLU . 72.1 Cg_endo -73.83 -35.78 4.14 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.016 2.478 . . . . 0.0 112.588 -177.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.2 t70 49.28 -10.49 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 127.481 2.312 . . . . 0.0 116.231 -177.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' B' ' 45' ' ' PRO . 15.7 pt-20 -69.4 -16.97 63.61 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.921 -1.112 . . . . 0.0 111.831 -177.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 42.0 mtm -74.09 -12.22 60.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.95 0.5 . . . . 0.0 111.297 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' B' ' 49' ' ' LEU . 87.9 mt -108.37 -17.28 14.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -68.19 -21.08 64.89 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.425 ' O ' ' HE2' ' B' ' 54' ' ' LYS . 4.2 pp -98.68 -6.82 28.92 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 122.881 0.472 . . . . 0.0 112.174 177.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.442 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.9 mt -89.9 -15.19 32.66 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.918 0.781 . . . . 0.0 109.906 166.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.59 22.68 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.532 1.133 . . . . 0.0 111.296 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.442 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.5 pttt -135.16 -4.11 2.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.78 0.832 . . . . 0.0 112.087 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -155.96 -5.83 0.12 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.143 0 CA-C-N 118.958 0.799 . . . . 0.0 112.853 -176.831 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 m . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 111.524 0.194 . . . . 0.0 111.524 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.1 tp -52.63 -30.81 33.51 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.485 0.714 . . . . 0.0 112.597 -177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.97 -20.79 78.06 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.427 -176.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -79.07 -1.0 33.68 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 117.42 0.61 . . . . 0.0 111.684 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -134.1 -13.88 2.4 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.452 0.301 . . . . 0.0 111.594 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 tp -80.23 -42.08 23.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.197 -0.314 . . . . 0.0 110.166 173.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.453 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.37 -45.47 99.86 Favored Pre-proline 0 CA--C 1.531 0.219 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -175.272 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 74.3 Cg_endo -70.64 -4.16 14.05 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.373 2.048 . . . . 0.0 112.177 -178.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.31 10.17 4.84 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.413 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 48.3 mt -57.26 -40.34 84.0 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.351 -0.833 . . . . 0.0 112.434 173.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 88.1 Cg_endo -77.87 -16.47 14.44 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 CA-C-N 120.842 1.337 . . . . 0.0 112.634 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -69.66 -24.98 63.69 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 118.435 0.561 . . . . 0.0 109.867 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.71 -21.65 65.3 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 175.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -92.46 -22.19 19.74 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.488 0.315 . . . . 0.0 110.386 178.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.3 ttp180 -52.69 -29.02 24.34 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 124.271 1.028 . . . . 0.0 110.773 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -138.27 -9.69 1.49 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 111.433 0.16 . . . . 0.0 111.433 177.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.96 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.89 -29.98 66.21 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.99 0.895 . . . . 0.0 110.264 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.23 -2.01 32.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.431 0.692 . . . . 0.0 111.358 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.3 mt -114.9 5.13 15.02 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.629 0.772 . . . . 0.0 111.501 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.8 p -141.6 -22.63 0.73 Allowed 'General case' 0 C--O 1.231 0.109 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.86 17.29 50.14 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.287 0.494 . . . . 0.0 112.08 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.2 t -153.45 131.97 12.16 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.62 0.71 . . . . 0.0 110.023 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.94 -20.77 64.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.872 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -70.94 -38.5 72.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.065 0.393 . . . . 0.0 110.578 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -82.19 -28.25 32.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.21 0.204 . . . . 0.0 110.745 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.6 -39.03 26.56 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.781 -0.927 . . . . 0.0 110.781 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -73.31 -30.37 63.33 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.283 0.542 . . . . 0.0 111.088 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -25.22 27.68 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 120.178 -0.609 . . . . 0.0 111.413 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -63.57 -37.91 89.13 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.076 0.853 . . . . 0.0 109.442 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.3 t -63.79 -46.65 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 117.704 0.229 . . . . 0.0 110.772 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -79.21 -32.59 44.05 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.534 -175.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.53 -25.99 63.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.13 -43.76 94.28 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.88 -41.28 62.42 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.573 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -62.46 -26.75 68.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.121 -0.362 . . . . 0.0 111.823 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.59 0.63 29.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.898 0.479 . . . . 0.0 111.363 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 72.6 mt -120.66 -13.47 8.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.227 1.011 . . . . 0.0 109.866 -177.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.6 t -58.83 -11.48 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 123.62 0.768 . . . . 0.0 111.921 175.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.75 3.0 9.52 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 123.47 0.708 . . . . 0.0 110.579 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.12 53.66 0.96 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 123.888 0.875 . . . . 0.0 110.978 -174.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.23 -10.12 27.97 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.933 2.422 . . . . 0.0 113.264 -175.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -78.96 -17.84 54.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.415 0.552 . . . . 0.0 110.654 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -78.56 -1.19 32.81 Favored 'General case' 0 C--N 1.335 -0.062 0 C-N-CA 125.025 1.33 . . . . 0.0 111.464 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -131.26 60.51 53.3 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 123.559 0.744 . . . . 0.0 109.995 -176.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.25 171.52 15.88 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 124.057 3.172 . . . . 0.0 111.409 -176.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -115.51 12.84 16.29 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.167 0.987 . . . . 0.0 109.658 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -72.27 10.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.71 1.204 . . . . 0.0 111.507 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.95 174.87 12.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 124.386 1.074 . . . . 0.0 109.504 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -55.4 148.05 34.78 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -68.34 10.62 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 123.865 3.043 . . . . 0.0 112.139 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -129.08 -25.06 2.8 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.012 0.525 . . . . 0.0 111.18 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.82 -32.98 68.13 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.522 0.601 . . . . 0.0 110.189 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.38 -34.14 57.91 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 177.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.39 -43.65 96.98 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.961 0.381 . . . . 0.0 109.992 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.14 -32.23 44.32 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -62.46 -41.12 98.53 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.179 -0.326 . . . . 0.0 110.959 -178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -80.93 -29.94 35.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.665 -177.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -66.86 -35.89 81.08 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -67.38 -27.68 67.3 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.114 0.566 . . . . 0.0 109.807 176.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.07 -39.86 92.96 Favored Glycine 0 CA--C 1.528 0.871 0 CA-C-O 119.796 -0.447 . . . . 0.0 112.055 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 48.6 mm -72.9 -37.97 55.55 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.071 0 CA-C-N 118.132 0.966 . . . . 0.0 110.264 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -31.79 70.1 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -31.4 61.56 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 121.309 -0.869 . . . . 0.0 110.503 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.8 t -75.52 -28.04 58.96 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.587 0.355 . . . . 0.0 110.988 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.92 70.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 122.158 -0.339 . . . . 0.0 110.124 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -72.57 -16.03 61.75 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.382 -0.199 . . . . 0.0 110.954 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.27 4.36 39.28 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.888 0.475 . . . . 0.0 110.968 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -133.29 -4.33 3.03 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.41 0.684 . . . . 0.0 111.128 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.39 -4.98 62.45 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.591 -0.561 . . . . 0.0 113.186 175.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -67.17 135.07 52.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.891 0.845 . . . . 0.0 110.31 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -165.69 173.57 10.63 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.451 0.701 . . . . 0.0 110.58 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -147.37 168.52 21.61 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 124.231 1.012 . . . . 0.0 109.085 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.4 t -64.9 -21.37 66.8 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.795 0.438 . . . . 0.0 111.363 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 92.1 p 44.72 24.16 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.767 1.627 . . . . 0.0 114.226 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -56.01 -60.41 3.52 Favored 'General case' 0 CA--C 1.527 0.065 0 C-N-CA 123.139 0.576 . . . . 0.0 111.572 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 81.0 p -178.79 177.53 0.86 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 123.558 0.743 . . . . 0.0 110.635 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -138.18 17.74 2.79 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.365 1.066 . . . . 0.0 108.797 175.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.62 -173.59 4.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.188 0.995 . . . . 0.0 110.219 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -139.81 10.8 2.44 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.787 0.435 . . . . 0.0 112.014 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -167.62 9.28 0.05 OUTLIER Glycine 0 CA--C 1.529 0.958 0 CA-C-O 119.359 -0.689 . . . . 0.0 113.721 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.5 t -147.4 7.52 0.88 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.471 1.135 . . . . 0.0 111.946 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -152.43 -33.07 0.13 Allowed 'General case' 0 CA--C 1.528 0.117 0 O-C-N 121.935 -0.478 . . . . 0.0 109.79 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.12 -23.71 63.07 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.9 p -66.84 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.138 0 C-N-CA 122.664 0.386 . . . . 0.0 110.03 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.7 -17.12 52.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 122.732 0.413 . . . . 0.0 111.137 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -88.1 -51.34 5.85 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.26 -1.67 4.86 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -171.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -130.22 6.22 4.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.015 0.526 . . . . 0.0 111.996 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 84.9 mt -144.5 19.27 1.7 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.791 0.836 . . . . 0.0 110.782 -178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.51 5.95 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -130.39 0.97 4.57 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.337 0.971 . . . . 0.0 112.255 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 ttm -68.17 152.15 45.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.2 m -59.25 137.88 88.5 Favored Pre-proline 0 CA--C 1.532 0.251 0 C-N-CA 123.178 0.591 . . . . 0.0 109.667 176.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.36 5.42 1.55 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.933 3.089 . . . . 0.0 114.01 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -130.95 -32.68 1.62 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.632 0.651 . . . . 0.0 110.298 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.6 m -62.64 -19.38 63.74 Favored 'General case' 0 CA--C 1.527 0.069 0 O-C-N 121.852 -0.53 . . . . 0.0 110.39 173.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.83 -33.84 76.78 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.071 0.548 . . . . 0.0 110.517 175.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -77.59 -30.37 52.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.53 -32.35 73.07 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.07 -0.394 . . . . 0.0 110.289 175.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 38.2 tp -66.32 -44.13 84.25 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.763 0.425 . . . . 0.0 110.438 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.87 -10.01 59.08 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.456 0.571 . . . . 0.0 111.677 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.8 mt -96.58 -4.71 40.73 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 67.7 p -137.19 6.05 2.8 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -177.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -139.54 10.55 2.49 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 177.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.5 mtm -140.07 -10.11 1.14 Allowed 'General case' 0 C--N 1.341 0.216 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -148.1 -8.25 0.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.225 0.92 . . . . 0.0 112.634 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 70.22 20.0 76.26 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.296 -0.724 . . . . 0.0 113.848 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -58.0 150.6 20.38 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.64 1.22 . . . . 0.0 109.884 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.2 p -70.24 160.79 79.61 Favored Pre-proline 0 C--O 1.233 0.207 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.82 -16.07 45.25 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 121.933 1.755 . . . . 0.0 110.521 176.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -79.28 -37.43 37.85 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 117.94 0.336 . . . . 0.0 110.823 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -76.95 -36.09 56.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 117.938 0.335 . . . . 0.0 110.129 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.0 -27.53 64.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.591 -0.243 . . . . 0.0 111.227 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.97 -36.44 64.58 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.727 0.298 . . . . 0.0 110.575 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -68.52 -31.11 70.13 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.861 0.465 . . . . 0.0 110.688 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.86 -7.45 57.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 8.6 pt -135.72 13.92 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.739 0.699 . . . . 0.0 111.992 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 56.8 53.61 8.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 29.1 m -137.16 179.13 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 122.936 0.494 . . . . 0.0 110.399 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.31 161.32 20.48 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.758 0.423 . . . . 0.0 110.178 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.7 m -60.74 -36.55 79.19 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.057 -0.402 . . . . 0.0 110.919 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -23.95 61.48 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.371 0.268 . . . . 0.0 110.946 -178.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.39 -36.55 68.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.789 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.7 t -64.81 -36.5 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -62.87 -34.57 77.66 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.651 0.263 . . . . 0.0 110.594 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.1 m -77.03 -37.52 54.74 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 177.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mp -66.46 -32.79 74.38 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.074 -0.489 . . . . 0.0 111.694 -178.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.62 -26.59 12.52 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.873 0.761 . . . . 0.0 110.811 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 99.0 m -68.89 -37.72 79.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -76.34 -27.62 56.56 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 122.273 -0.267 . . . . 0.0 110.319 176.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.4 -48.07 62.22 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.852 0.296 . . . . 0.0 110.471 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.87 -22.74 65.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 117.855 0.298 . . . . 0.0 111.129 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.44 -38.62 59.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 173.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -69.46 -30.11 67.94 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 119.757 -0.163 . . . . 0.0 110.571 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.9 mm -64.71 -49.41 80.35 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.69 -20.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -77.76 -20.88 52.61 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -176.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -151.69 -10.63 0.21 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.4 p . . . . . 0 N--CA 1.464 0.257 0 CA-C-N 119.951 1.25 . . . . 0.0 112.164 179.092 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 . . . . . 0 CA--C 1.528 0.113 0 CA-C-O 120.672 0.272 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.2 tpt -52.93 -26.97 16.71 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.634 0.773 . . . . 0.0 112.349 -177.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.22 -40.54 87.7 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.24 -22.7 60.36 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.549 -0.383 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.88 -37.83 67.18 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 81.7 mt -73.97 -37.41 64.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.98 -32.45 72.86 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 119.533 -0.27 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 62.3 m -66.62 -43.86 83.62 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.221 0.464 . . . . 0.0 110.705 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -26.97 65.12 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -103.7 -16.54 15.43 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 122.111 -0.368 . . . . 0.0 111.526 -176.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tp60 -64.45 -33.67 76.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 169.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -55.15 -38.66 68.54 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.157 0.583 . . . . 0.0 110.646 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 95.6 m -67.06 -12.61 60.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.835 0.454 . . . . 0.0 112.208 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 69.6 mt -105.54 -14.89 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.048 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -75.54 19.51 0.19 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.855 0.462 . . . . 0.0 111.53 176.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -136.48 169.05 18.31 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.054 0.454 . . . . 0.0 111.055 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -56.37 165.31 1.11 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.761 1.224 . . . . 0.0 113.129 -173.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.5 m -125.92 155.61 72.79 Favored Pre-proline 0 C--O 1.232 0.169 0 C-N-CA 124.022 0.929 . . . . 0.0 109.663 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.9 179.62 6.32 Favored 'Trans proline' 0 N--CA 1.448 -1.152 0 C-N-CA 122.938 2.425 . . . . 0.0 109.898 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -146.77 0.25 0.75 Allowed 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.589 0.356 . . . . 0.0 111.071 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -67.81 -18.13 64.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -175.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.9 mpp? -70.22 -29.15 65.9 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-N 118.204 0.456 . . . . 0.0 109.8 176.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.45 ' N ' HD22 ' B' ' 49' ' ' LEU . 2.4 mm? -93.31 -25.02 17.92 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.49 -20.88 66.53 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.4 pp -98.11 0.61 46.39 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.492 0.317 . . . . 0.0 111.626 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' B' ' 52' ' ' LEU . 23.8 mt -83.84 -21.83 31.92 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 166.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -66.12 17.28 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.1 0.96 . . . . 0.0 113.155 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.4 pttt -128.12 6.18 5.92 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.427 0.691 . . . . 0.0 111.236 177.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.2 -15.51 0.35 Allowed 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.107 0.563 . . . . 0.0 111.591 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.342 0 CA-C-N 117.935 0.334 . . . . 0.0 110.697 171.184 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.233 0.225 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.52 -26.68 66.45 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.335 0.654 . . . . 0.0 111.228 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.95 -23.14 78.41 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.744 -0.598 . . . . 0.0 112.046 -176.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -81.17 2.99 25.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.865 0.466 . . . . 0.0 111.004 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -131.51 -21.71 2.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.532 0.733 . . . . 0.0 111.089 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.3 tp -78.55 -38.79 39.54 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.298 -0.251 . . . . 0.0 110.926 176.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.413 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.8 -45.78 99.78 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -172.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 77.4 Cg_endo -72.86 -3.84 14.31 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.487 2.125 . . . . 0.0 113.285 -175.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.7 m80 -135.71 8.7 3.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.368 0.531 . . . . 0.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.8 tp -56.38 -44.03 99.55 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 124.14 0.976 . . . . 0.0 113.107 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.484 ' HG2' HD11 ' B' ' 40' ' ' ILE . 67.6 Cg_endo -81.8 -11.76 11.26 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.203 1.936 . . . . 0.0 113.373 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -64.9 -23.49 67.24 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 118.942 0.792 . . . . 0.0 111.255 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.75 -19.03 65.67 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 122.252 -0.28 . . . . 0.0 110.9 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm105 -103.03 -20.91 14.02 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.702 0.401 . . . . 0.0 111.042 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -62.84 -16.43 58.44 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.364 0.529 . . . . 0.0 111.805 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -140.32 -21.3 0.84 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.578 0.351 . . . . 0.0 111.449 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.66 -25.1 68.61 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 111.56 -0.616 . . . . 0.0 111.56 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -66.86 -12.12 58.11 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.386 0.593 . . . . 0.0 111.977 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -114.12 -6.45 13.07 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 122.962 0.505 . . . . 0.0 111.881 -174.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.5 mt -82.76 -0.36 47.34 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.04 0.382 . . . . 0.0 111.22 174.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 t -148.29 -4.13 0.47 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -175.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.16 17.04 78.54 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 121.553 -0.717 . . . . 0.0 113.034 174.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.3 t -156.1 126.23 6.56 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.143 0.971 . . . . 0.0 110.272 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -69.32 -19.04 63.88 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.715 -0.22 . . . . 0.0 110.78 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -74.29 -33.14 63.15 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -76.46 -35.11 58.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -71.36 -36.1 63.28 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -73.02 -34.67 66.5 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 117.565 0.682 . . . . 0.0 111.451 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.82 -22.93 49.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.431 178.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -67.32 -36.79 82.19 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 37.3 t -60.4 -47.01 94.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 CA-C-N 117.932 0.333 . . . . 0.0 110.58 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -77.38 -29.86 53.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.511 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.67 -27.39 61.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.604 -0.147 . . . . 0.0 110.604 176.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 59.4 m -66.93 -38.9 87.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.43 -44.1 53.34 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -176.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.3 -24.67 67.74 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 122.081 -0.387 . . . . 0.0 110.522 -178.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.38 0.16 23.48 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.378 0.671 . . . . 0.0 111.636 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.5 mt -122.7 -14.02 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 124.008 0.923 . . . . 0.0 109.879 -177.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.0 t -58.92 -15.54 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.142 0.577 . . . . 0.0 112.021 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.19 4.98 9.77 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.344 0.658 . . . . 0.0 110.884 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.18 53.88 0.91 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.144 0.578 . . . . 0.0 111.199 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -64.7 -10.83 26.26 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.291 2.66 . . . . 0.0 112.405 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.57 -15.34 61.29 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.494 0.318 . . . . 0.0 110.878 175.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -85.68 0.5 52.54 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.722 0.409 . . . . 0.0 111.664 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -129.17 63.99 69.3 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 122.799 0.44 . . . . 0.0 110.296 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.24 168.36 21.1 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 124.214 3.276 . . . . 0.0 111.918 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.53 12.17 10.73 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.054 0.942 . . . . 0.0 109.795 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -72.68 10.68 0.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.196 0.998 . . . . 0.0 111.52 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.4 m -135.86 174.69 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 C-N-CA 124.2 1.0 . . . . 0.0 109.216 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.31 146.23 32.92 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.104 0.161 . . . . 0.0 110.824 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.07 11.78 0.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 124.242 3.294 . . . . 0.0 112.37 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -128.75 -16.6 4.18 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.028 0.531 . . . . 0.0 110.428 174.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.63 -35.87 38.75 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 118.136 0.426 . . . . 0.0 109.888 -178.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.61 -32.63 45.68 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.2 -46.6 89.17 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.059 0.543 . . . . 0.0 110.214 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -74.05 -33.85 63.85 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.721 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.6 tpm_? -63.77 -43.15 97.23 Favored 'General case' 0 C--N 1.337 0.05 0 CA-C-N 118.728 0.695 . . . . 0.0 111.116 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 88.8 mmm -71.0 -34.38 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.576 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -68.82 -37.07 78.94 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.325 -0.234 . . . . 0.0 110.748 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -67.94 -20.17 65.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.509 0.323 . . . . 0.0 110.377 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.1 -40.41 50.81 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.4 mm -73.61 -34.34 41.47 Favored 'Isoleucine or valine' 0 C--N 1.338 0.089 0 CA-C-N 117.552 0.676 . . . . 0.0 109.852 176.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.0 t90 -65.54 -36.36 83.57 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.419 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.06 69.53 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.082 -0.386 . . . . 0.0 110.563 177.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.1 t -75.07 -28.93 60.53 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.317 0.247 . . . . 0.0 110.743 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.02 64.77 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.334 -0.229 . . . . 0.0 111.049 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -86.64 -12.84 47.32 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.465 0.306 . . . . 0.0 110.758 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.4 4.56 34.84 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.191 0.596 . . . . 0.0 111.131 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -137.7 0.82 2.27 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.107 0.563 . . . . 0.0 111.033 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.34 13.13 83.12 Favored Glycine 0 CA--C 1.528 0.885 0 CA-C-O 119.676 -0.514 . . . . 0.0 113.12 176.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -64.25 -18.38 64.5 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 117.949 0.875 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.42 155.15 31.61 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.119 0.968 . . . . 0.0 109.095 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -146.89 -10.68 0.45 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.8 t -164.52 174.52 10.82 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.767 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.7 p -155.82 167.3 30.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.736 0.814 . . . . 0.0 110.087 177.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -152.29 -50.34 0.11 Allowed 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 122.452 -0.155 . . . . 0.0 111.279 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -169.31 160.49 9.49 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.506 0.322 . . . . 0.0 110.985 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -160.24 23.73 0.16 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.082 0.953 . . . . 0.0 110.037 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.39 174.75 10.47 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.163 0.506 . . . . 0.0 111.227 -176.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -9.38 17.32 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.86 -11.79 0.14 Allowed Glycine 0 CA--C 1.527 0.828 0 CA-C-O 119.566 -0.575 . . . . 0.0 113.121 178.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.5 p -66.65 -3.54 6.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.295 1.047 . . . . 0.0 113.066 -176.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -129.19 -29.76 2.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.92 68.27 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -65.89 -29.86 48.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.444 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -0.06 53.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.395 0.678 . . . . 0.0 111.809 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -130.48 -16.59 3.43 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.865 0.302 . . . . 0.0 111.229 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.45 -1.42 15.67 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.855 0.462 . . . . 0.0 110.447 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -130.49 -12.87 3.88 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.352 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 73.8 mt -144.82 34.21 1.13 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.338 0.655 . . . . 0.0 111.247 -171.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.7 2.88 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -130.52 -5.92 4.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.532 1.06 . . . . 0.0 112.3 -177.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.8 ttm -67.35 146.05 54.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.325 0.511 . . . . 0.0 110.31 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 93.9 m -65.65 137.25 96.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.83 -20.75 39.05 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.578 2.185 . . . . 0.0 112.956 -174.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -78.61 -34.73 46.43 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.3 m -65.36 -23.41 66.98 Favored 'General case' 0 N--CA 1.457 -0.105 0 O-C-N 122.043 -0.411 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 62.6 mtm180 -67.88 -26.0 65.79 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.063 0.392 . . . . 0.0 110.556 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -77.72 -39.0 45.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.57 -33.25 74.65 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 122.082 -0.386 . . . . 0.0 110.202 177.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -54.43 46.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.974 0.509 . . . . 0.0 109.721 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.504 ' HA ' ' HE3' ' A' ' 107' ' ' MET . 4.4 pp -71.53 -15.44 62.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.1 mt -84.24 -9.3 58.63 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.882 0.31 . . . . 0.0 111.827 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.4 p -135.44 12.47 3.5 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -132.48 -0.65 3.57 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.504 ' HE3' ' HA ' ' A' ' 103' ' ' LEU . 33.3 mtm -145.9 -11.79 0.5 Allowed 'General case' 0 C--N 1.34 0.173 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -138.09 -2.91 1.82 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.23 0.923 . . . . 0.0 112.266 -175.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 55.58 26.47 45.81 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.167 -0.796 . . . . 0.0 114.315 173.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -56.68 151.62 13.63 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.493 1.146 . . . . 0.0 110.633 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.4 t -64.55 149.38 95.46 Favored Pre-proline 0 N--CA 1.453 -0.285 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 171.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -64.44 -16.54 55.67 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.938 1.759 . . . . 0.0 110.648 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -76.18 -39.85 53.81 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 117.767 0.258 . . . . 0.0 110.344 176.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -74.63 -35.26 62.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 122.119 -0.363 . . . . 0.0 110.312 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.04 -28.1 67.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.22 -0.3 . . . . 0.0 111.053 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.32 -27.69 42.1 Favored 'General case' 0 CA--C 1.526 0.05 0 C-N-CA 122.541 0.336 . . . . 0.0 110.403 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -75.13 -22.62 58.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.258 1.023 . . . . 0.0 111.037 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 69.8 mt -88.49 -7.88 55.8 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 7.5 pt -135.55 15.23 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.726 0.694 . . . . 0.0 111.351 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 46.13 62.17 2.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.952 1.701 . . . . 0.0 114.691 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 31.2 m -136.9 -179.78 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 C-N-CA 124.077 0.951 . . . . 0.0 109.392 174.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -81.41 159.93 24.19 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -60.6 -36.87 79.62 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 122.152 -0.342 . . . . 0.0 110.799 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.0 t -72.91 -24.64 60.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.134 0.174 . . . . 0.0 110.932 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.95 -34.14 68.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.085 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.9 t -65.72 -38.04 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.109 0 CA-C-N 118.211 0.46 . . . . 0.0 109.769 177.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.66 -35.78 77.07 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.7 m -76.29 -37.98 56.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.342 -0.224 . . . . 0.0 110.743 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mp -65.17 -36.19 83.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.666 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.44 -28.5 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-N 118.515 0.598 . . . . 0.0 110.974 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.7 m -68.67 -38.79 80.65 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -78.17 -26.17 47.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 122.356 -0.215 . . . . 0.0 110.638 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.21 -50.74 37.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.57 -22.51 65.38 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 117.73 0.241 . . . . 0.0 111.1 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.29 -34.77 76.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -81.59 -18.62 44.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.261 176.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 25.9 mm -68.91 -53.13 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 173.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.65 -16.83 62.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -64.91 -21.44 66.82 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -155.57 -43.32 0.08 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -171.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -169.097 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 25.0 t70 . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 120.92 0.391 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -64.42 -25.65 68.11 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.968 0.507 . . . . 0.0 112.136 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.48 -34.69 60.14 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.63 -18.54 60.54 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 117.325 0.562 . . . . 0.0 110.865 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.63 -41.15 27.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 62.0 mt -71.02 -41.56 70.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.255 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -70.84 -25.9 63.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.928 -0.482 . . . . 0.0 111.314 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 45.5 t -64.74 -44.82 88.89 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.791 0.723 . . . . 0.0 109.769 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.4 -24.62 65.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -105.36 -1.51 25.02 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 122.088 -0.382 . . . . 0.0 111.62 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -79.79 -40.09 29.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -66.88 -16.88 64.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 175.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -88.01 -8.34 55.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.371 0.668 . . . . 0.0 112.496 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.484 HD11 ' HG2' ' A' ' 12' ' ' PRO . 7.2 tp -123.22 -7.95 7.88 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 CA-C-N 119.334 0.97 . . . . 0.0 112.909 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -80.6 33.62 0.31 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.173 0.589 . . . . 0.0 112.036 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -130.87 175.57 8.95 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.113 0.482 . . . . 0.0 111.918 -174.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -64.04 178.05 0.71 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.704 1.201 . . . . 0.0 112.747 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.59 156.04 74.96 Favored Pre-proline 0 CA--C 1.53 0.192 0 C-N-CA 122.918 0.487 . . . . 0.0 110.998 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -77.67 -178.86 4.92 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.577 2.851 . . . . 0.0 110.044 173.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -148.65 -1.9 0.5 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -66.51 -20.49 66.04 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.939 -0.476 . . . . 0.0 111.905 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 3.1 mpp? -67.93 -36.81 80.77 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' B' ' 49' ' ' LEU . 82.6 mt -83.43 -12.46 56.38 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.117 -0.364 . . . . 0.0 110.213 178.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -72.43 -20.57 61.39 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.937 -0.477 . . . . 0.0 109.882 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -73.63 -19.57 60.82 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 173.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.423 ' C ' ' H ' ' B' ' 54' ' ' LYS . 15.8 mt -78.93 -22.6 45.53 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.136 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -73.41 9.38 1.35 Allowed 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 172.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' B' ' 52' ' ' LEU . 36.9 ttpt -120.72 -0.55 10.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.064 1.346 . . . . 0.0 110.588 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.2 pp -149.65 -15.36 0.27 Allowed 'General case' 0 C--N 1.345 0.374 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 CA-C-N 118.668 0.667 . . . . 0.0 112.399 -178.671 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m . . . . . 0 CA--C 1.534 0.329 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.6 tp -63.42 -30.56 71.67 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 122.186 -0.321 . . . . 0.0 111.488 -177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -65.66 -35.42 91.06 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.3 mp0 -73.4 3.33 6.11 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.399 0.68 . . . . 0.0 111.115 177.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -128.42 0.58 5.65 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.283 0.633 . . . . 0.0 111.078 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.66 -39.54 2.74 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.952 0.501 . . . . 0.0 111.091 177.088 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.427 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.99 -44.78 99.62 Favored Pre-proline 0 CA--C 1.53 0.209 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -175.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 82.9 Cg_endo -75.71 3.48 5.93 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.173 1.916 . . . . 0.0 111.907 -179.139 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -130.28 9.42 5.19 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.9 mt -54.86 -44.24 99.29 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.58 -15.0 11.24 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 121.715 1.61 . . . . 0.0 112.708 -175.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -71.59 -25.33 62.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.462 0.573 . . . . 0.0 111.221 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.9 mt -69.53 -27.32 65.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 118.145 0.429 . . . . 0.0 110.009 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -88.76 -29.18 19.98 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.53 0.732 . . . . 0.0 110.544 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.5 ttp180 -53.83 -25.58 20.2 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.674 1.19 . . . . 0.0 112.759 -175.177 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -140.56 -20.98 0.83 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.25 -27.99 70.09 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -69.26 -33.01 72.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 117.557 0.679 . . . . 0.0 110.289 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.95 -11.44 59.9 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.0 mt -86.07 4.39 38.34 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.03 0.377 . . . . 0.0 111.213 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.8 t -149.31 -18.13 0.28 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.97 11.24 82.87 Favored Glycine 0 CA--C 1.526 0.719 0 CA-C-O 119.47 -0.628 . . . . 0.0 113.75 171.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -148.28 140.03 23.79 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.349 1.075 . . . . 0.0 110.864 -179.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -73.36 -19.22 61.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.365 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -73.72 -37.68 65.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 178.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -79.67 -32.59 41.49 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 176.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.4 -47.1 82.49 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.81 -33.02 74.73 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.594 0.697 . . . . 0.0 110.313 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.496 ' HE3' ' CE1' ' A' ' 31' ' ' TYR . 5.9 tmmm? -67.5 -46.78 71.93 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.63 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.496 ' CE1' ' HE3' ' A' ' 30' ' ' LYS . 22.7 m-85 -69.06 -36.07 77.24 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.392 0.542 . . . . 0.0 111.552 -178.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 t -60.81 -52.25 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -77.29 -27.83 53.14 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 122.423 -0.173 . . . . 0.0 111.375 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -24.24 63.23 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.721 -0.181 . . . . 0.0 110.847 175.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.0 m -67.82 -40.08 83.83 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.432 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -73.59 -42.25 61.81 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.138 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -59.63 -25.49 64.71 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.995 -0.44 . . . . 0.0 111.858 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 0.49 31.33 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.797 0.439 . . . . 0.0 111.011 178.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 81.6 mt -120.9 -13.89 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -61.79 -10.64 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.87 0.868 . . . . 0.0 111.708 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.7 3.0 9.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.001 0.52 . . . . 0.0 111.296 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.1 55.36 0.97 Allowed Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.385 0.674 . . . . 0.0 110.304 -177.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.47 -10.63 28.45 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 123.318 2.679 . . . . 0.0 112.753 -173.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -81.52 -11.69 59.09 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 122.067 -0.395 . . . . 0.0 111.005 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -86.73 -14.61 41.92 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -65.31 114.9 17.26 Favored Pre-proline 0 CA--C 1.529 0.165 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -78.78 135.29 12.64 Favored 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 122.991 2.461 . . . . 0.0 112.193 -174.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -125.76 1.91 7.45 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 125.054 1.342 . . . . 0.0 109.976 175.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -79.42 9.56 4.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.086 0.954 . . . . 0.0 111.719 -178.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.3 m -137.93 -179.08 2.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 C-N-CA 123.846 0.858 . . . . 0.0 109.967 -176.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -52.65 152.96 6.07 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.301 0.641 . . . . 0.0 110.81 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.78 7.3 0.59 Allowed 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.383 3.389 . . . . 0.0 112.588 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -127.17 -25.02 3.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.221 0.608 . . . . 0.0 110.843 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 54' ' ' LEU . 28.7 mt -70.31 -33.9 72.08 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.039 0.381 . . . . 0.0 110.648 178.05 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.97 -41.0 93.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.62 -42.47 91.5 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.975 0.51 . . . . 0.0 109.977 177.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -77.47 -30.25 53.07 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -175.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -66.12 -41.99 89.76 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.71 0.687 . . . . 0.0 110.754 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.1 mmm -71.12 -34.76 71.37 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.502 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -71.0 -35.07 71.94 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 117.618 0.19 . . . . 0.0 110.752 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.25 -27.65 68.8 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.516 0.326 . . . . 0.0 110.204 177.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -72.71 -36.39 58.23 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -70.59 -38.24 72.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.101 0 CA-C-N 117.657 0.729 . . . . 0.0 110.142 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 76.0 t90 -69.29 -32.04 70.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 122.251 -0.281 . . . . 0.0 110.897 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.82 -32.94 68.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 122.099 -0.376 . . . . 0.0 110.179 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -74.11 -25.49 59.81 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.597 0.359 . . . . 0.0 110.484 178.006 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.38 65.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 122.392 -0.192 . . . . 0.0 110.626 179.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -69.79 -16.52 63.3 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.115 -0.366 . . . . 0.0 110.614 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.48 7.51 46.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.23 0.612 . . . . 0.0 111.208 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -134.24 -4.89 2.68 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 111.66 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 112.88 25.56 4.46 Favored Glycine 0 C--N 1.341 0.825 0 C-N-CA 120.911 -0.662 . . . . 0.0 114.372 173.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -128.64 171.53 12.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.558 1.179 . . . . 0.0 110.637 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 51.01 25.69 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.195 0.998 . . . . 0.0 112.576 -176.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -67.51 -7.19 23.85 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -152.42 -19.87 0.17 Allowed 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.292 0.496 . . . . 0.0 111.706 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.0 m 49.85 26.4 1.92 Allowed 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -56.54 153.12 10.63 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.767 0.427 . . . . 0.0 110.071 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.4 p -136.47 170.68 15.66 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.791 0.436 . . . . 0.0 110.922 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -152.92 23.3 0.57 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.946 0.498 . . . . 0.0 111.291 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.72 162.03 2.51 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.958 -0.464 . . . . 0.0 111.734 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.25 -13.55 62.33 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -173.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.62 20.39 0.06 OUTLIER Glycine 0 CA--C 1.527 0.791 0 CA-C-O 119.421 -0.655 . . . . 0.0 113.448 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 8.9 t -134.18 5.45 3.54 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.304 1.052 . . . . 0.0 112.322 -176.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -150.97 -30.1 0.19 Allowed 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.42 -22.79 65.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.6 p -71.53 -29.9 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.586 0.354 . . . . 0.0 110.328 176.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.71 7.7 28.94 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.774 0.83 . . . . 0.0 111.568 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -127.97 -40.37 1.7 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.389 0.676 . . . . 0.0 110.062 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.2 -1.77 8.76 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.525 0.33 . . . . 0.0 111.786 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 63.6 mtt180 -130.84 -3.0 4.1 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 123.022 0.529 . . . . 0.0 111.926 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.429 HD21 HD13 ' A' ' 137' ' ' ILE . 73.6 mt -136.35 14.59 3.24 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.362 0.528 . . . . 0.0 111.51 -172.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.79 18.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.424 1.09 . . . . 0.0 112.124 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 91' ' ' LEU . 85.2 mmt-85 -126.34 11.28 7.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.373 0.669 . . . . 0.0 112.064 -174.162 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 20.4 ptp -122.78 164.5 18.24 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 117.921 0.328 . . . . 0.0 110.304 175.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 63.5 m -62.45 143.29 96.09 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 123.258 0.623 . . . . 0.0 110.286 -176.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -53.06 -0.62 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 124.95 3.767 . . . . 0.0 115.139 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 31.1 tp -119.47 -19.44 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.406 0.548 . . . . 0.0 110.564 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.6 m -69.1 -27.72 65.85 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 mtp-105 -69.9 -26.79 64.33 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.525 0.33 . . . . 0.0 110.16 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -81.06 -39.34 25.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.13 -34.36 77.88 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.15 -49.26 68.03 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.557 0.343 . . . . 0.0 110.812 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.71 -4.65 35.8 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 115' ' ' ALA . 14.7 tp -106.64 -4.44 19.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.817 0.447 . . . . 0.0 111.772 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 72.8 p -140.11 5.02 2.08 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.007 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.9 -1.06 6.61 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.587 0.631 . . . . 0.0 112.541 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.433 ' HE2' ' HB2' ' B' ' 32' ' ' LEU . 8.3 ptp -150.71 12.27 0.69 Allowed 'General case' 0 C--N 1.338 0.091 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -143.75 -12.26 0.67 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.723 0.692 . . . . 0.0 111.995 176.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 67.2 15.07 64.92 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.994 -0.892 . . . . 0.0 114.135 173.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -60.93 146.68 45.91 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.844 1.322 . . . . 0.0 110.231 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.7 m -65.98 153.51 91.46 Favored Pre-proline 0 N--CA 1.454 -0.24 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.51 -17.26 43.56 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.555 2.17 . . . . 0.0 111.24 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -74.93 -34.39 62.1 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 117.847 0.294 . . . . 0.0 110.711 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -82.26 -34.54 28.73 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.423 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -67.0 -27.48 67.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.437 0.295 . . . . 0.0 110.698 175.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.71 -32.91 53.23 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.46 -23.53 62.71 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.397 0.679 . . . . 0.0 111.213 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -88.82 -5.32 58.12 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 16.9 pt -135.13 12.07 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 O-C-N 121.875 -0.515 . . . . 0.0 111.071 176.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 54.42 58.22 5.12 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.898 1.279 . . . . 0.0 113.566 176.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.47 -178.71 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.807 0.843 . . . . 0.0 109.816 176.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -83.96 160.79 20.98 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.3 m -58.67 -36.96 74.99 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 122.018 -0.427 . . . . 0.0 110.912 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 97.6 p -72.66 -20.93 61.16 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -76.27 -33.38 59.12 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 121.97 -0.456 . . . . 0.0 110.084 178.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.9 t -66.22 -37.56 79.98 Favored 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.69 -32.19 73.22 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.444 0.164 . . . . 0.0 110.858 177.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.4 m -76.1 -39.43 55.27 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.515 177.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.44 -33.78 76.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.224 -0.417 . . . . 0.0 111.456 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.2 m -78.5 -26.44 13.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.138 0 CA-C-N 118.765 0.711 . . . . 0.0 111.12 177.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 60.7 m -68.45 -40.08 81.22 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.1 -27.42 60.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.8 -48.68 36.0 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 122.473 -0.142 . . . . 0.0 110.653 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 117.909 0.322 . . . . 0.0 111.731 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.82 -41.0 62.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 174.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -72.35 -22.24 61.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 119.513 -0.279 . . . . 0.0 110.461 178.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.429 HD13 HD21 ' A' ' 91' ' ' LEU . 12.7 mm -75.29 -44.3 42.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.514 0.597 . . . . 0.0 109.745 176.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -69.51 -20.48 63.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -94.7 -8.02 38.99 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -172.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -155.29 -12.06 0.11 Allowed 'General case' 0 C--N 1.34 0.193 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -175.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 41.1 p . . . . . 0 N--CA 1.467 0.387 0 CA-C-N 119.941 1.246 . . . . 0.0 112.354 -178.804 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 CA--C 1.532 0.278 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.7 tpt -58.5 -26.6 63.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -70.43 -34.24 68.28 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.8 -22.16 43.41 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 117.285 0.543 . . . . 0.0 110.541 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.98 71.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.816 0.341 . . . . 0.0 110.099 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.433 ' HB2' ' HE2' ' A' ' 107' ' ' MET . 90.7 mt -74.78 -31.62 61.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.219 178.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -67.72 -37.66 82.53 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 117.94 0.336 . . . . 0.0 110.42 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -65.86 -37.23 85.64 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.833 0.288 . . . . 0.0 110.499 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.74 -29.12 68.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -102.23 -14.08 17.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 O-C-N 122.083 -0.386 . . . . 0.0 111.585 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -66.99 -36.76 82.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.78 -31.96 70.16 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.621 0.368 . . . . 0.0 110.791 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 96.1 m -73.68 -8.95 58.02 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.228 0.611 . . . . 0.0 112.327 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 16.7 tt -123.54 -7.18 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 118.77 0.714 . . . . 0.0 111.776 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.11 24.38 0.13 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.406 -0.809 . . . . 0.0 110.714 171.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -131.94 171.92 12.98 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.485 0.714 . . . . 0.0 111.179 -175.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -67.54 -177.34 0.73 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.399 1.079 . . . . 0.0 112.113 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 35.2 m -132.39 150.36 75.72 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.809 0.844 . . . . 0.0 109.231 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.29 -25.98 5.39 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.169 2.58 . . . . 0.0 113.051 -175.007 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 51.89 4.07 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.881 1.272 . . . . 0.0 114.015 -176.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -66.0 -22.12 66.44 Favored 'General case' 0 CA--C 1.528 0.108 0 O-C-N 121.461 -0.774 . . . . 0.0 111.243 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 27.6 mtm -70.71 -34.2 71.68 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.661 0.384 . . . . 0.0 111.017 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 71.7 mt -82.52 -15.03 53.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.888 -0.507 . . . . 0.0 109.884 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -70.31 -20.49 63.01 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.995 -0.441 . . . . 0.0 109.837 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.03 -14.7 61.47 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.192 -0.318 . . . . 0.0 110.655 173.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.427 ' C ' ' H ' ' B' ' 54' ' ' LYS . 31.1 mt -86.72 -20.93 26.97 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.093 173.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -69.84 16.23 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.705 0.402 . . . . 0.0 111.928 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.427 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -135.04 5.41 3.3 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.724 0.81 . . . . 0.0 111.175 177.446 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.425 ' C ' HD12 ' B' ' 55' ' ' LEU . 2.5 pp -151.52 -2.73 0.31 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 177.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.237 0 CA-C-N 118.426 0.557 . . . . 0.0 110.101 175.983 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.6 tp -60.98 -35.75 77.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 121.974 0.11 . . . . 0.0 111.099 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.85 -29.16 67.63 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.168 -177.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -74.91 0.91 14.1 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.545 0.738 . . . . 0.0 110.251 176.405 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -137.12 8.37 2.95 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.419 1.088 . . . . 0.0 110.687 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.6 tp -118.31 -38.89 3.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.223 0.609 . . . . 0.0 110.622 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.433 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.77 -44.58 97.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.281 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.433 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 95.8 Cg_endo -74.09 -0.22 9.27 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.282 1.988 . . . . 0.0 112.631 -176.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.422 ' CE1' ' HE ' ' A' ' 53' ' ' ARG . 39.1 m-70 -133.67 3.17 3.52 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.017 0.527 . . . . 0.0 111.158 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.433 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 55.2 tp -59.64 -43.49 95.63 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 124.632 1.173 . . . . 0.0 113.786 -177.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.433 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 92.8 Cg_endo -75.0 -10.67 21.32 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.741 1.628 . . . . 0.0 112.367 -176.02 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-30 -66.57 -22.59 66.14 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.594 0.634 . . . . 0.0 111.365 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -74.05 -17.15 61.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.209 -0.307 . . . . 0.0 110.557 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.7 ttt85 -105.06 -26.25 12.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.763 0.425 . . . . 0.0 111.221 -175.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -61.68 -19.6 62.52 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 122.877 0.471 . . . . 0.0 111.647 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -136.83 -11.88 1.75 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.423 0.289 . . . . 0.0 111.143 175.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.27 -38.64 96.55 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 177.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.9 mtm105 -68.69 -24.9 64.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.105 0.953 . . . . 0.0 110.423 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.42 4.15 36.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.691 0.797 . . . . 0.0 111.253 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 tp -126.74 4.59 6.69 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.979 0.912 . . . . 0.0 110.297 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.3 p -135.81 -9.52 2.1 Favored 'General case' 0 C--N 1.338 0.078 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.76 2.36 44.41 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-O 119.494 -0.615 . . . . 0.0 114.093 173.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 t -157.03 140.08 15.38 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.262 1.031 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -66.54 -20.99 66.16 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.207 177.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -78.81 -32.03 46.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -79.01 -40.24 31.98 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.45 -32.31 83.72 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -71.88 -39.71 69.43 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 117.129 0.465 . . . . 0.0 111.264 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -26.43 30.77 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 120.458 -0.497 . . . . 0.0 112.122 -177.241 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -69.17 -35.43 76.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 119.097 0.862 . . . . 0.0 110.059 176.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.0 t -65.01 -43.71 96.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.147 0 CA-C-O 120.643 0.259 . . . . 0.0 110.526 176.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.3 ttp-105 -78.76 -28.48 44.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 122.302 -0.249 . . . . 0.0 111.661 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.57 -29.73 65.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 65.0 m -65.15 -37.88 88.82 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.4 OUTLIER -77.8 -42.72 32.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -177.037 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -63.41 -24.66 67.94 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.795 -0.565 . . . . 0.0 110.475 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.14 -0.08 26.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.406 0.682 . . . . 0.0 111.528 176.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 92.2 mt -120.24 -15.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.836 0.854 . . . . 0.0 109.696 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.02 -14.37 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.367 0.667 . . . . 0.0 110.775 173.099 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.85 4.41 9.43 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.679 0.792 . . . . 0.0 110.937 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.28 55.5 1.41 Allowed Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.33 0.652 . . . . 0.0 111.494 -177.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -68.43 -4.72 13.48 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.368 2.045 . . . . 0.0 110.868 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -85.81 4.11 38.53 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.2 1.0 . . . . 0.0 111.662 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -131.26 20.88 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.119 0.418 . . . . 0.0 111.358 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -131.83 53.67 12.09 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.457 0.703 . . . . 0.0 110.073 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.77 171.72 17.67 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.148 3.232 . . . . 0.0 112.752 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.416 ' C ' ' H ' ' A' ' 50' ' ' VAL . 5.1 mpt_? -113.08 18.82 17.72 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.179 1.392 . . . . 0.0 110.126 175.411 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.09 4.41 0.9 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.989 0.916 . . . . 0.0 110.809 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.416 ' H ' ' C ' ' A' ' 48' ' ' ARG . 30.4 m -135.73 177.75 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 125.462 1.505 . . . . 0.0 108.494 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -57.93 148.47 59.46 Favored Pre-proline 0 C--O 1.232 0.173 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.33 10.69 0.53 Allowed 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.793 2.995 . . . . 0.0 111.666 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HE ' ' CE1' ' A' ' 10' ' ' HIS . 98.9 mtt180 -126.52 -16.67 5.27 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 124.029 0.932 . . . . 0.0 110.613 177.719 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -45.3 64.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.47 -32.83 82.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.68 -50.08 74.38 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.227 -0.656 . . . . 0.0 109.227 178.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -76.71 -29.64 56.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.572 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -68.14 -42.03 80.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 119.671 -0.204 . . . . 0.0 111.145 -176.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.4 mmm -79.41 -31.31 42.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.994 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -68.02 -38.82 83.01 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.939 0.336 . . . . 0.0 110.212 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 tm0? -70.74 -25.2 62.82 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 122.506 0.322 . . . . 0.0 110.199 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.77 -39.75 85.66 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -72.34 -36.75 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.109 0 CA-C-N 118.194 0.997 . . . . 0.0 109.698 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -68.71 -35.61 77.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.522 -0.111 . . . . 0.0 110.916 -177.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.44 -31.12 66.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 176.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -72.48 -28.01 62.64 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.05 -36.7 58.93 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.384 -0.198 . . . . 0.0 110.549 177.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -73.51 -14.07 61.15 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.298 -0.251 . . . . 0.0 110.488 175.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.18 9.49 39.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.426 0.691 . . . . 0.0 110.458 176.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.3 -8.52 3.35 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.076 0.551 . . . . 0.0 111.056 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 149.91 -22.46 1.14 Allowed Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.311 -0.716 . . . . 0.0 114.708 173.042 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.07 140.01 58.78 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.424 1.112 . . . . 0.0 110.771 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -174.54 15.65 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.655 0.782 . . . . 0.0 111.516 178.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -84.28 170.91 13.19 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.11 0.481 . . . . 0.0 110.699 -176.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -64.13 152.7 39.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.005 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.7 p -164.33 9.25 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -175.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -63.51 -11.02 20.72 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -169.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.7 p -158.7 167.59 29.12 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.944 0.793 . . . . 0.0 112.05 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -149.31 19.11 0.95 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.135 0.974 . . . . 0.0 110.522 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.29 -171.57 3.87 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.481 0.712 . . . . 0.0 109.918 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -134.02 12.11 3.94 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.802 0.441 . . . . 0.0 111.604 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -163.9 9.56 0.08 OUTLIER Glycine 0 CA--C 1.53 0.97 0 CA-C-O 119.702 -0.499 . . . . 0.0 114.054 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 t -148.0 -0.25 0.61 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.106 0.953 . . . . 0.0 111.71 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -141.95 -36.16 0.43 Allowed 'General case' 0 C--O 1.228 -0.056 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.05 -28.79 69.11 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.042 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.06 -32.39 54.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.738 0.304 . . . . 0.0 110.561 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.23 0.09 55.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.42 0.688 . . . . 0.0 112.296 -175.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -132.26 -12.21 3.18 Favored 'General case' 0 C--O 1.227 -0.119 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.3 -3.42 36.61 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 173.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.507 ' C ' HD22 ' A' ' 91' ' ' LEU . 70.9 mtt85 -122.62 -12.49 8.11 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.75 0.82 . . . . 0.0 111.03 177.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.507 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.4 mm? -134.8 36.04 3.1 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.661 1.184 . . . . 0.0 110.085 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.412 ' C ' ' HD2' ' A' ' 93' ' ' ARG . . . -61.19 9.23 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.412 ' HD2' ' C ' ' A' ' 92' ' ' ALA . 2.8 mpt_? -130.42 0.42 4.52 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.922 0.783 . . . . 0.0 111.798 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.5 ttm -69.28 144.07 53.69 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.569 0.622 . . . . 0.0 109.797 177.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.441 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 24.2 m -67.19 137.47 94.19 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 123.052 0.541 . . . . 0.0 110.74 -178.223 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 50.6 Cg_exo -55.5 2.98 0.07 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 125.133 3.888 . . . . 0.0 115.448 176.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -128.63 -33.75 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.816 0.735 . . . . 0.0 109.937 -176.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 51.0 m -64.91 -25.42 67.88 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 121.922 -0.486 . . . . 0.0 110.115 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -70.46 -29.56 66.15 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 122.563 0.345 . . . . 0.0 110.413 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -72.71 -37.85 67.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.66 -31.56 68.52 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.082 -0.386 . . . . 0.0 110.173 176.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.49 -47.01 77.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.17 -11.16 60.43 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.712 -0.617 . . . . 0.0 111.544 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 65.2 mt -91.4 -5.1 54.95 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.103 -0.373 . . . . 0.0 111.627 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 68.5 p -135.55 6.32 3.23 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.58 7.91 1.94 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.059 0.544 . . . . 0.0 111.229 177.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.6 mtm -146.61 -2.1 0.67 Allowed 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -176.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -150.18 -17.59 0.25 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.919 0.781 . . . . 0.0 112.17 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 74.4 16.31 79.97 Favored Glycine 0 C--N 1.34 0.784 0 CA-C-O 119.345 -0.697 . . . . 0.0 114.005 173.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -61.27 149.88 36.49 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.639 1.22 . . . . 0.0 110.192 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.8 m -73.73 156.0 88.65 Favored Pre-proline 0 C--O 1.232 0.162 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -53.15 -27.18 36.14 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 123.198 2.598 . . . . 0.0 113.248 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.13 -33.89 70.52 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.938 -0.476 . . . . 0.0 110.798 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -83.53 -35.54 24.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.66 -29.6 67.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.148 0.179 . . . . 0.0 111.351 178.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.18 -32.93 50.32 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.574 0.226 . . . . 0.0 110.662 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -69.11 -30.87 69.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 52.5 mt -75.51 -6.5 50.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 10.1 pt -135.24 11.2 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 118.796 0.725 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 53.78 56.18 7.51 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.857 1.263 . . . . 0.0 113.955 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.4 m -135.98 176.08 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 C-N-CA 123.455 0.702 . . . . 0.0 110.183 175.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -73.31 156.77 38.09 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 120.859 0.362 . . . . 0.0 110.333 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 33.3 m -60.48 -35.9 77.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 121.95 -0.469 . . . . 0.0 110.978 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 89.5 p -75.54 -21.3 58.05 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.976 -0.453 . . . . 0.0 111.512 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -74.44 -43.13 57.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.365 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.7 p -67.25 -29.6 46.41 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.221 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.38 -33.86 76.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.1 m -75.94 -36.23 59.43 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.4 -35.1 79.48 Favored 'General case' 0 CA--C 1.527 0.094 0 O-C-N 122.195 -0.315 . . . . 0.0 111.546 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.7 m -79.15 -26.59 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 118.442 0.564 . . . . 0.0 111.02 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 51.9 m -67.13 -35.49 79.85 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -81.01 -25.06 37.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.478 -0.139 . . . . 0.0 110.873 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.83 -43.6 68.22 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 122.189 -0.319 . . . . 0.0 110.229 179.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -74.84 -22.23 58.81 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.177 0.191 . . . . 0.0 110.748 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.37 -34.84 73.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -75.73 -22.89 56.13 Favored 'General case' 0 N--CA 1.457 -0.116 0 O-C-N 122.289 -0.257 . . . . 0.0 110.54 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.0 mm -73.49 -52.52 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.148 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -69.83 -20.5 63.43 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -175.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -72.02 -20.69 61.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -154.06 -37.82 0.1 Allowed 'General case' 0 N--CA 1.458 -0.067 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -173.532 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 56.4 p . . . . . 0 N--CA 1.467 0.406 0 C-N-CA 126.274 1.83 . . . . 0.0 115.796 -168.186 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 110.882 -0.044 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.1 tpt -54.13 -35.06 61.79 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.18 -37.19 94.11 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.97 -15.6 58.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.36 -0.494 . . . . 0.0 111.254 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.3 -58.11 3.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.629 ' H ' HD23 ' B' ' 32' ' ' LEU . 1.9 pt? -81.51 -13.25 58.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.489 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -69.5 -35.6 75.69 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.582 0.628 . . . . 0.0 109.408 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 36.4 t -66.54 -35.41 80.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.7 -31.76 72.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 110.923 175.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -87.39 -20.86 26.09 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 121.759 -0.588 . . . . 0.0 111.059 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -69.51 -36.03 76.09 Favored 'General case' 0 CA--C 1.526 0.027 0 CA-C-N 118.447 0.567 . . . . 0.0 111.131 -178.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -67.03 -16.69 64.52 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 118.057 0.389 . . . . 0.0 111.115 178.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -79.16 -13.31 59.8 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 110.56 -0.163 . . . . 0.0 110.56 173.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.424 ' C ' ' H ' ' B' ' 42' ' ' GLU . 30.8 mm -102.46 -18.45 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 118.213 0.461 . . . . 0.0 111.052 -178.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -74.88 28.92 0.09 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.596 0.758 . . . . 0.0 110.663 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' B' ' 40' ' ' ILE . 80.6 mm-40 -137.67 177.62 7.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.084 0.954 . . . . 0.0 110.794 -174.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -65.82 179.33 0.88 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.889 0.876 . . . . 0.0 111.489 177.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.42 151.52 74.89 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.074 0.55 . . . . 0.0 110.173 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.07 79.15 3.47 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.091 3.194 . . . . 0.0 110.869 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.43 -3.77 0.49 Allowed 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -61.25 -23.77 65.89 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.766 -0.584 . . . . 0.0 112.179 179.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -69.26 -33.63 73.54 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 118.268 0.485 . . . . 0.0 110.211 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 78.7 mt -83.51 -13.03 55.51 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.89 -0.506 . . . . 0.0 110.561 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -71.12 -23.47 62.1 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.58 -17.89 61.13 Favored 'General case' 0 CA--C 1.523 -0.072 0 C-N-CA 122.741 0.417 . . . . 0.0 110.804 174.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.439 ' C ' ' H ' ' B' ' 54' ' ' LYS . 37.2 mt -90.59 -14.76 31.85 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.317 -0.24 . . . . 0.0 110.889 173.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -72.35 18.54 0.09 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.062 0.945 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.6 pttt -137.14 6.11 2.82 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.472 1.109 . . . . 0.0 110.978 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -149.31 -18.5 0.28 Allowed 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.254 0 CA-C-N 118.314 0.506 . . . . 0.0 112.02 178.893 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 CA--C 1.528 0.102 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.0 tp -54.92 -33.68 62.41 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.909 0.484 . . . . 0.0 111.755 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.49 -23.92 65.31 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.79 -0.569 . . . . 0.0 112.007 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -81.0 -0.4 39.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.427 0.613 . . . . 0.0 111.177 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -134.37 3.56 3.36 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.403 0.681 . . . . 0.0 110.432 -178.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 7' ' ' LEU . 0.8 OUTLIER -106.06 -41.65 5.31 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.873 0.869 . . . . 0.0 108.952 178.05 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.434 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -60.84 -43.5 91.85 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.219 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 74.3 Cg_endo -72.69 -4.46 15.38 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.386 2.057 . . . . 0.0 113.284 -173.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -135.56 12.77 3.47 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.236 0.471 . . . . 0.0 110.801 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -56.03 -41.05 89.02 Favored Pre-proline 0 CA--C 1.537 0.474 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -179.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.49 -8.28 12.62 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 121.954 1.77 . . . . 0.0 112.466 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.92 -21.42 65.99 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.855 0.752 . . . . 0.0 110.834 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 63.4 mt -73.09 -18.98 61.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.795 0.27 . . . . 0.0 110.487 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.9 mtt-85 -97.93 -19.75 17.88 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -53.6 -27.24 25.59 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.88 1.272 . . . . 0.0 111.833 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.8 p90 -140.44 -14.86 0.97 Allowed 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.681 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.5 -29.73 75.93 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -70.77 -3.68 20.01 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.23 1.015 . . . . 0.0 112.037 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.32 6.36 7.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.631 0.772 . . . . 0.0 110.398 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.4 tp -107.96 6.63 27.37 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.293 1.037 . . . . 0.0 110.103 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.8 p -132.87 -19.28 2.31 Favored 'General case' 0 C--O 1.23 0.047 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.28 -2.84 87.39 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-O 119.672 -0.515 . . . . 0.0 112.712 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.6 t -157.92 139.26 13.54 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.214 1.007 . . . . 0.0 110.858 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -65.23 -20.1 66.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.42 -0.175 . . . . 0.0 111.184 178.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -72.99 -34.56 66.49 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 178.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -83.18 -29.02 28.91 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.226 -0.286 . . . . 0.0 110.226 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.52 -40.98 67.05 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.67 -33.67 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 117.434 0.617 . . . . 0.0 110.684 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -69.72 -45.92 67.11 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 119.469 -0.301 . . . . 0.0 111.448 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -67.65 -32.58 73.36 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.453 0.57 . . . . 0.0 111.248 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.6 t -63.94 -50.15 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 CA-C-N 118.173 0.442 . . . . 0.0 110.673 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -75.74 -27.38 58.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.974 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.8 -23.03 59.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.741 -0.171 . . . . 0.0 110.828 176.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.0 m -63.57 -48.0 79.21 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.446 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -70.58 -35.26 72.95 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.73 0.3 . . . . 0.0 110.333 -178.157 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -67.12 -16.66 64.46 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.876 -0.515 . . . . 0.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -87.39 -6.88 58.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.956 -0.465 . . . . 0.0 111.281 174.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 36.2 mm -98.36 -27.59 3.68 Favored 'Isoleucine or valine' 0 C--N 1.339 0.122 0 CA-C-N 117.856 0.298 . . . . 0.0 110.682 -179.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.0 m -66.69 -7.09 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -89.81 -15.83 31.48 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 118.077 0.399 . . . . 0.0 110.559 175.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -170.04 89.67 0.53 Allowed Pre-proline 0 CA--C 1.532 0.273 0 C-N-CA 124.199 1.0 . . . . 0.0 109.2 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.48 -5.97 15.35 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.029 2.486 . . . . 0.0 112.219 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.6 -14.51 59.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.497 0.319 . . . . 0.0 110.623 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -83.87 9.35 12.29 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.273 0.629 . . . . 0.0 111.352 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -130.54 79.97 71.13 Favored Pre-proline 0 N--CA 1.451 -0.412 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.43 157.59 61.17 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.303 2.669 . . . . 0.0 111.408 -173.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 7.46 2.77 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.256 1.022 . . . . 0.0 110.493 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.7 9.49 1.8 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.623 1.169 . . . . 0.0 110.835 174.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.2 m -131.77 -172.43 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 C-N-CA 124.509 1.123 . . . . 0.0 109.272 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -58.43 148.98 62.55 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.26 13.19 0.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 124.169 3.246 . . . . 0.0 112.372 -177.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -129.11 -16.95 3.95 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 119.312 -0.375 . . . . 0.0 111.371 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' A' ' 54' ' ' LEU . 18.4 mt -71.56 -39.03 70.91 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.649 0.659 . . . . 0.0 110.479 179.458 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.2 -39.02 94.34 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -54.3 47.77 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.541 0.736 . . . . 0.0 110.147 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -72.3 -36.29 68.89 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.81 -175.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 52.9 tpt85 -60.77 -41.84 96.31 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.617 0.644 . . . . 0.0 111.394 -174.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.8 mmm -81.38 -26.8 35.19 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.521 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -68.17 -38.0 81.59 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.686 0.676 . . . . 0.0 110.323 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -67.75 -24.79 65.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.47 0.308 . . . . 0.0 110.242 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.22 -37.89 71.81 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -72.25 -40.04 64.97 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 CA-C-N 117.985 0.892 . . . . 0.0 109.999 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -69.14 -35.58 76.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 122.555 -0.091 . . . . 0.0 110.825 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.86 -27.69 65.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 122.387 -0.196 . . . . 0.0 110.689 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.1 t -82.72 -18.14 41.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.286 0.234 . . . . 0.0 110.703 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -46.75 30.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.327 0.251 . . . . 0.0 110.823 -179.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -77.41 -15.89 59.11 Favored 'General case' 0 CA--C 1.527 0.09 0 O-C-N 122.276 -0.265 . . . . 0.0 111.211 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.71 2.03 24.26 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.412 0.685 . . . . 0.0 111.237 176.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -137.75 0.9 2.27 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.089 0.556 . . . . 0.0 111.362 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 87.41 5.94 78.48 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 119.728 -0.484 . . . . 0.0 113.327 175.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.65 -15.41 63.51 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.155 0.978 . . . . 0.0 111.405 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -160.11 153.77 22.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.726 0.81 . . . . 0.0 109.75 177.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -146.33 -9.4 0.5 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.699 0.4 . . . . 0.0 112.046 177.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -165.84 176.85 7.58 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.397 0.679 . . . . 0.0 109.681 -178.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.4 p -152.65 155.91 38.22 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.772 0.429 . . . . 0.0 110.464 177.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -157.26 162.28 39.2 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.8 m -139.0 165.54 26.86 Favored 'General case' 0 C--O 1.23 0.055 0 O-C-N 122.084 -0.385 . . . . 0.0 110.79 -177.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -149.34 25.92 0.87 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.879 0.472 . . . . 0.0 110.994 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.07 164.88 1.47 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.983 0.42 . . . . 0.0 111.307 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.97 -10.65 30.95 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -174.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 157.04 21.74 0.03 OUTLIER Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.255 -0.747 . . . . 0.0 113.437 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.5 t -137.51 6.73 2.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.423 1.111 . . . . 0.0 112.955 -175.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -143.03 -35.89 0.39 Allowed 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.709 0.403 . . . . 0.0 110.043 173.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.44 -27.06 67.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.8 p -66.56 -27.62 40.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 C-N-CA 122.536 0.334 . . . . 0.0 110.422 178.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.66 -0.45 55.17 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.013 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -130.29 -18.52 3.24 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 118.149 0.431 . . . . 0.0 112.087 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.1 -1.82 31.09 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.766 0.426 . . . . 0.0 110.543 174.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.595 ' C ' HD12 ' A' ' 91' ' ' LEU . 99.4 mtt180 -130.24 -13.49 3.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.004 0.522 . . . . 0.0 112.317 -177.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.595 HD12 ' C ' ' A' ' 90' ' ' ARG . 9.9 mp -129.68 15.51 5.92 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.481 0.713 . . . . 0.0 111.611 -172.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.33 9.51 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 177.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 91' ' ' LEU . 66.9 mtt85 -124.6 15.34 8.8 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.545 0.738 . . . . 0.0 110.892 -176.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 39.3 ttm -115.35 142.38 46.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.028 0.931 . . . . 0.0 109.467 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.504 HG23 ' H ' ' A' ' 98' ' ' SER . 5.7 t -68.04 140.42 93.49 Favored Pre-proline 0 CA--C 1.531 0.22 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -53.2 -22.73 20.63 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.968 3.112 . . . . 0.0 114.418 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -79.3 -46.27 18.04 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.031 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.504 ' H ' HG23 ' A' ' 95' ' ' THR . 55.6 m -67.81 -23.54 65.2 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.214 -0.304 . . . . 0.0 111.175 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.0 ttp180 -67.73 -33.32 74.63 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.22 -37.49 61.09 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 177.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.85 76.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 178.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.1 tp -61.78 -50.92 70.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.577 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 3.8 pp -79.44 0.88 27.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 115' ' ' ALA . 14.8 tp -97.29 -6.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.231 -0.293 . . . . 0.0 111.391 177.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.8 p -140.53 -16.78 0.9 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -81.53 -12.89 58.66 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.465 1.03 . . . . 0.0 113.045 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.577 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 1.8 pmm? -154.08 14.9 0.47 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -129.58 -11.99 4.42 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.525 0.602 . . . . 0.0 112.052 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 68.51 7.55 53.57 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-O 118.887 -0.951 . . . . 0.0 114.761 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -58.39 150.34 22.52 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.354 1.577 . . . . 0.0 110.634 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.9 p -71.8 161.28 79.54 Favored Pre-proline 0 N--CA 1.454 -0.269 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.48 -16.49 47.5 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.059 1.84 . . . . 0.0 111.02 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -79.17 -45.05 20.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 117.884 0.311 . . . . 0.0 110.572 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -74.07 -32.0 63.08 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.413 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -69.54 -22.67 63.54 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.239 0.216 . . . . 0.0 110.991 177.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.11 -29.79 34.75 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.516 0.198 . . . . 0.0 110.694 179.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.3 -38.94 82.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.663 0.385 . . . . 0.0 111.333 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 57.0 mt -72.91 -4.06 29.61 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 12.5 pt -135.41 11.64 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 118.986 0.812 . . . . 0.0 111.281 177.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 52.03 59.57 4.44 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.905 1.282 . . . . 0.0 113.827 176.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.03 -178.42 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 123.521 0.728 . . . . 0.0 109.932 176.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -83.28 160.26 21.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 86.2 m -60.49 -37.56 81.49 Favored 'General case' 0 C--O 1.232 0.177 0 O-C-N 121.954 -0.466 . . . . 0.0 110.579 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.9 t -70.5 -24.51 62.86 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 122.364 -0.21 . . . . 0.0 111.029 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -71.68 -37.53 70.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.126 178.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.05 -38.63 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-N 118.401 0.546 . . . . 0.0 109.842 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -58.78 -37.86 77.26 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 110.508 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.7 m -78.05 -38.4 44.54 Favored 'General case' 0 N--CA 1.457 -0.085 0 O-C-N 122.432 -0.167 . . . . 0.0 110.656 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 60.3 mt -64.85 -33.35 75.79 Favored 'General case' 0 N--CA 1.456 -0.139 0 O-C-N 122.082 -0.386 . . . . 0.0 111.672 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.3 m -80.56 -28.68 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 CA-C-N 118.587 0.631 . . . . 0.0 110.521 177.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 89.5 m -68.58 -38.2 80.5 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -76.72 -27.62 55.51 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.267 -0.271 . . . . 0.0 110.888 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.67 -49.85 55.74 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 122.23 -0.294 . . . . 0.0 110.309 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.02 -22.34 62.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.716 -0.183 . . . . 0.0 111.131 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.91 -37.18 64.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.746 0.248 . . . . 0.0 110.726 177.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -74.45 -19.35 60.42 Favored 'General case' 0 N--CA 1.457 -0.079 0 CA-C-N 117.599 0.182 . . . . 0.0 110.544 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 19.2 mm -75.11 -56.39 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.79 -16.64 64.21 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -70.71 -22.29 62.46 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 179.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -157.57 -38.15 0.07 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -173.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 30.3 p . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 124.504 1.121 . . . . 0.0 112.274 -169.483 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.532 0.27 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -60.83 -27.0 67.75 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.302 0.501 . . . . 0.0 111.492 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.35 -33.69 61.32 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.669 -0.973 . . . . 0.0 110.669 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.49 -23.02 37.63 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 117.163 0.482 . . . . 0.0 110.841 179.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.05 -43.02 72.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' LEU . . . . . 0.422 ' HB2' ' HE2' ' A' ' 107' ' ' MET . 85.2 mt -70.25 -39.34 75.05 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.112 177.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.93 -35.29 78.19 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.053 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.1 t -65.81 -42.94 90.05 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.477 0.581 . . . . 0.0 110.214 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.9 66.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.592 0.357 . . . . 0.0 111.81 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -110.77 -14.89 13.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 62.0 tp60 -68.33 -38.19 81.29 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.74 -24.99 67.74 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.211 0.078 . . . . 0.0 111.211 176.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 39.8 m -72.04 -12.59 61.29 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 47.0 pt -129.1 8.36 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 118.403 0.547 . . . . 0.0 111.92 -178.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.56 24.72 0.56 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.26 0.624 . . . . 0.0 111.536 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -144.77 -178.32 5.96 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.859 -0.526 . . . . 0.0 111.622 -176.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -61.91 175.96 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.583 1.153 . . . . 0.0 111.808 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.2 m -135.33 155.88 78.36 Favored Pre-proline 0 C--O 1.232 0.156 0 C-N-CA 122.924 0.49 . . . . 0.0 111.064 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.2 176.24 2.12 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.844 3.03 . . . . 0.0 112.472 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -148.55 -2.39 0.5 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.389 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -65.29 -24.85 67.41 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.681 0.393 . . . . 0.0 111.483 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 45.2 mtm -76.18 -36.7 58.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.403 0.281 . . . . 0.0 110.956 -179.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 64.2 mt -77.72 -15.58 59.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.616 -0.678 . . . . 0.0 109.736 175.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -71.11 -21.33 62.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.829 -0.545 . . . . 0.0 109.698 173.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.0 mt -71.56 -14.61 62.14 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 173.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' B' ' 54' ' ' LYS . 28.5 mt -89.73 -16.47 30.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.747 0.249 . . . . 0.0 111.48 174.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -71.09 18.35 0.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.415 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.8 pttt -133.91 2.7 3.41 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.31 0.644 . . . . 0.0 111.918 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -153.04 -3.3 0.22 Allowed 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.234 0 CA-C-N 118.751 0.705 . . . . 0.0 112.096 -178.413 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.2 p . . . . . 0 CA--C 1.527 0.093 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.1 tp -85.27 -31.73 22.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 117.997 0.362 . . . . 0.0 111.04 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.83 -30.62 74.54 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -73.11 2.18 7.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.903 0.881 . . . . 0.0 111.269 177.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -130.66 -20.37 2.9 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.461 0.704 . . . . 0.0 111.043 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.53 -32.51 18.15 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.568 0.347 . . . . 0.0 111.313 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.447 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.79 -44.28 96.83 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 72.2 Cg_endo -71.89 -2.32 11.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.098 1.866 . . . . 0.0 112.423 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -135.2 12.73 3.56 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.122 0.569 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.415 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 43.0 tp -57.82 -41.94 92.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.835 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 88.3 Cg_endo -76.67 -10.94 18.61 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.592 1.528 . . . . 0.0 112.275 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -70.78 -21.28 62.52 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-N 118.775 0.716 . . . . 0.0 110.814 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.4 mt -70.79 -28.18 64.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.831 0.287 . . . . 0.0 110.984 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ptm85 -105.04 -13.67 15.67 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 122.243 -0.286 . . . . 0.0 110.728 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -52.68 -25.81 12.02 Favored 'General case' 0 C--N 1.338 0.071 0 C-N-CA 123.911 0.884 . . . . 0.0 110.845 175.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -139.99 -10.1 1.15 Allowed 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 123.102 0.251 . . . . 0.0 111.576 175.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.0 -28.47 63.73 Favored Glycine 0 C--N 1.34 0.76 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 173.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.34 -8.4 39.61 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.199 0.6 . . . . 0.0 111.837 175.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -116.73 0.37 12.56 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.103 0.561 . . . . 0.0 111.622 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -97.61 -3.53 39.36 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.062 0.545 . . . . 0.0 111.379 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -156.59 -5.65 0.11 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.58 26.06 51.77 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 121.891 -0.506 . . . . 0.0 113.778 174.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 t -150.92 127.45 10.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.798 0.799 . . . . 0.0 109.553 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -71.82 -18.66 62.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.112 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -68.32 -42.67 79.04 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -81.17 -31.72 33.92 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 177.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.52 -42.54 93.57 Favored Glycine 0 C--N 1.335 0.515 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -72.51 -30.23 64.3 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 117.595 0.697 . . . . 0.0 110.148 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -71.09 -41.82 70.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.411 -0.328 . . . . 0.0 111.487 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -66.07 -44.21 85.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.412 0.551 . . . . 0.0 111.598 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.7 m -68.52 -34.72 66.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 CA-C-N 118.499 0.59 . . . . 0.0 110.97 -176.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.9 ttp180 -79.45 -32.45 42.68 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.094 -0.379 . . . . 0.0 110.825 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.61 63.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 64.5 m -64.61 -40.38 95.39 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.483 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -77.62 -34.98 53.16 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.73 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -61.67 -24.27 66.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.96 -0.462 . . . . 0.0 110.411 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.15 -16.17 59.24 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.593 0.357 . . . . 0.0 111.04 175.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 20.3 mm -90.57 -18.92 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 58.7 t -64.52 -4.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.277 0.631 . . . . 0.0 110.968 176.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.47 1.68 9.57 Favored 'General case' 0 C--N 1.34 0.177 0 O-C-N 121.697 -0.627 . . . . 0.0 111.195 178.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -158.16 54.35 0.74 Allowed Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 123.239 0.616 . . . . 0.0 111.094 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -72.08 -3.71 13.79 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.981 3.121 . . . . 0.0 112.034 -176.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -106.01 12.59 30.3 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.268 0.627 . . . . 0.0 112.131 -175.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -138.67 7.92 2.56 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -56.15 132.13 74.88 Favored Pre-proline 0 CA--C 1.531 0.237 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -69.97 120.94 7.6 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.346 2.697 . . . . 0.0 112.038 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.4 mmm180 -142.14 6.17 1.73 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.96 1.304 . . . . 0.0 110.205 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -82.53 13.3 3.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.117 0.967 . . . . 0.0 111.068 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.65 -166.73 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 125.03 1.332 . . . . 0.0 108.654 -177.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.54 144.09 18.35 Favored Pre-proline 0 N--CA 1.455 -0.195 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -65.87 2.02 1.96 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.899 2.399 . . . . 0.0 112.259 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -121.64 -18.35 7.19 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 123.616 0.766 . . . . 0.0 111.162 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -74.34 -31.21 62.34 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.262 0.483 . . . . 0.0 110.325 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.46 -33.99 68.05 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.74 -44.54 95.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -80.5 -19.87 44.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.315 -0.374 . . . . 0.0 111.782 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 24.3 tpt180 -70.48 -47.31 61.17 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.643 0.656 . . . . 0.0 110.548 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -71.34 -33.7 69.84 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.098 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -66.72 -39.85 88.16 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.288 -0.258 . . . . 0.0 111.314 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -68.41 -24.72 64.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.75 -37.57 84.48 Favored Glycine 0 C--N 1.339 0.717 0 N-CA-C 111.394 -0.683 . . . . 0.0 111.394 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.2 mm -73.48 -41.6 56.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.127 0 CA-C-N 117.84 0.82 . . . . 0.0 110.166 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.4 t90 -67.54 -38.17 83.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.713 0.233 . . . . 0.0 110.934 -176.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.05 -29.0 62.65 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.241 -0.287 . . . . 0.0 111.108 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 40.2 t -80.08 -30.68 39.27 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 117.539 0.154 . . . . 0.0 110.938 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.77 -31.0 59.33 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.411 -0.181 . . . . 0.0 111.182 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -85.33 -12.45 52.23 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 122.172 -0.33 . . . . 0.0 111.335 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.23 0.03 26.74 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -140.34 4.51 2.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.665 0.386 . . . . 0.0 111.362 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.13 6.21 88.33 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.941 -0.366 . . . . 0.0 112.809 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -75.59 5.14 6.41 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 117.664 0.732 . . . . 0.0 111.807 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -150.78 172.2 15.98 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.077 0.465 . . . . 0.0 111.131 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -146.66 -167.13 2.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.06 1.344 . . . . 0.0 108.729 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 10.4 t -138.9 164.17 30.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.993 0.517 . . . . 0.0 110.03 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.0 t -158.43 -172.72 3.97 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.398 0.679 . . . . 0.0 109.774 -176.076 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -148.58 8.55 0.79 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.5 m -146.14 142.13 28.18 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.896 0.771 . . . . 0.0 111.499 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -154.13 10.91 0.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.313 1.045 . . . . 0.0 110.403 175.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -153.81 -174.89 5.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.622 0.769 . . . . 0.0 109.582 -176.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -126.17 11.25 7.56 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.106 0.562 . . . . 0.0 110.764 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -166.18 9.71 0.06 OUTLIER Glycine 0 CA--C 1.527 0.843 0 CA-C-O 119.23 -0.761 . . . . 0.0 112.653 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.2 p -139.68 -7.58 1.27 Allowed 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.567 1.184 . . . . 0.0 112.917 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -137.93 -39.18 0.56 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.75 -25.41 67.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.9 p -66.66 -31.02 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 C-N-CA 122.542 0.337 . . . . 0.0 110.565 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.2 -1.08 52.13 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.223 0.609 . . . . 0.0 111.568 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -130.55 -15.07 3.61 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.49 0.316 . . . . 0.0 111.698 177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.92 -1.93 18.84 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.871 0.468 . . . . 0.0 110.468 174.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.556 ' C ' HD22 ' A' ' 91' ' ' LEU . 90.8 mtt-85 -129.25 -15.64 4.11 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.994 0.518 . . . . 0.0 111.536 178.161 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.556 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.5 mm? -138.02 36.44 2.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.114 0.966 . . . . 0.0 110.59 -172.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.88 7.77 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 82.3 mmt-85 -130.68 4.35 4.59 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.062 0.846 . . . . 0.0 112.361 -177.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 57.2 ttm -65.79 143.69 57.34 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.369 0.531 . . . . 0.0 111.168 -178.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 m -61.37 139.12 94.82 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.926 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -66.62 5.45 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 124.246 3.297 . . . . 0.0 113.564 -177.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.97 -35.03 2.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.5 m -62.42 -19.65 63.69 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.0 -0.437 . . . . 0.0 109.86 171.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -58.26 -41.34 84.06 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.664 0.786 . . . . 0.0 110.72 174.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -77.47 -38.49 49.17 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.73 74.43 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 122.243 -0.286 . . . . 0.0 110.825 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -66.56 -48.65 68.97 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.3 mt -67.93 -14.95 63.37 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.882 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.0 mt -98.72 -4.82 32.73 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.911 0.484 . . . . 0.0 111.909 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -136.27 10.24 3.24 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.99 4.94 2.31 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.9 mtm -140.8 -5.02 1.18 Allowed 'General case' 0 C--N 1.339 0.109 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -150.25 -5.88 0.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.382 0.992 . . . . 0.0 112.987 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.95 25.25 65.77 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-O 119.009 -0.884 . . . . 0.0 113.828 175.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -55.38 150.16 11.99 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.641 1.22 . . . . 0.0 110.08 177.096 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 69.7 m -68.39 153.26 95.86 Favored Pre-proline 0 CA--C 1.529 0.172 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.78 -28.62 39.09 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 123.188 2.592 . . . . 0.0 112.807 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -72.84 -32.82 65.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.23 -0.293 . . . . 0.0 110.772 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -83.52 -36.01 24.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 122.367 -0.208 . . . . 0.0 110.499 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.02 70.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 122.396 -0.19 . . . . 0.0 110.99 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.55 -28.58 33.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.66 0.384 . . . . 0.0 111.252 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -71.34 -27.62 63.5 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.651 0.78 . . . . 0.0 111.59 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.9 mt -85.78 -0.16 54.53 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ILE . . . . . 0.438 HG13 HG22 ' A' ' 121' ' ' VAL . 20.0 pt -135.42 9.86 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 118.509 0.595 . . . . 0.0 111.575 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 55.34 53.92 9.31 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.498 1.119 . . . . 0.0 113.87 175.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.438 HG22 HG13 ' A' ' 119' ' ' ILE . 23.3 m -134.79 174.94 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 C-N-CA 122.895 0.478 . . . . 0.0 110.023 174.34 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -76.29 158.37 31.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 37.2 m -59.87 -36.61 77.28 Favored 'General case' 0 C--N 1.334 -0.098 0 O-C-N 122.109 -0.37 . . . . 0.0 111.149 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 93.4 p -76.88 -20.92 55.7 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 121.79 -0.569 . . . . 0.0 111.1 -178.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.0 -44.02 55.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.059 178.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.07 -31.23 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.238 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -62.4 -35.32 78.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.707 0.23 . . . . 0.0 110.408 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.6 m -75.63 -36.65 60.16 Favored 'General case' 0 N--CA 1.457 -0.097 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 178.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.1 mp -67.37 -36.58 81.65 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 119.263 -0.399 . . . . 0.0 111.191 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.9 m -76.47 -26.09 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.128 0 CA-C-N 118.937 0.789 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 82.5 m -66.59 -35.79 81.06 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -80.85 -26.77 36.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.364 -0.21 . . . . 0.0 110.623 177.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.53 73.1 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.43 -0.169 . . . . 0.0 110.63 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -78.18 -22.33 48.78 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.916 -0.49 . . . . 0.0 110.333 177.52 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.82 -38.71 70.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.214 -0.304 . . . . 0.0 110.466 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -78.85 -18.83 53.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.349 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 5.6 mm -63.68 -51.16 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.12 -17.04 61.44 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -71.89 -17.67 62.1 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -149.82 -41.98 0.14 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 N--CA 1.469 0.484 0 N-CA-C 117.367 2.358 . . . . 0.0 117.367 -175.297 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 . . . . . 0 CA--C 1.531 0.228 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.3 tpt -62.14 -28.7 69.83 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.108 0.413 . . . . 0.0 110.359 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.98 62.89 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -17.44 62.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.157 0.479 . . . . 0.0 111.103 178.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.98 -41.69 20.4 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 20.0 mt -70.82 -37.76 73.24 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.64 -29.14 69.1 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.357 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t -67.29 -40.39 86.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.746 0.703 . . . . 0.0 110.277 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.75 -24.23 64.42 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -105.55 -12.49 15.94 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -72.38 -37.99 68.59 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -65.33 -21.86 66.75 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.804 -0.141 . . . . 0.0 110.789 177.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 60.8 m -73.89 -13.23 60.88 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 117.628 0.195 . . . . 0.0 111.282 174.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 63.6 mt -98.26 -23.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 O-C-N 121.933 -0.479 . . . . 0.0 109.934 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.78 27.2 0.18 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.757 0.823 . . . . 0.0 112.103 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -139.57 175.9 9.18 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -64.68 177.62 0.9 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.193 0.997 . . . . 0.0 112.023 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.11 154.28 77.32 Favored Pre-proline 0 C--O 1.233 0.23 0 C-N-CA 123.774 0.829 . . . . 0.0 109.794 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -76.25 -26.59 8.85 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.912 2.408 . . . . 0.0 113.341 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p30 45.15 0.98 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.254 2.222 . . . . 0.0 116.599 -177.096 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.78 -17.06 64.68 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.243 0.929 . . . . 0.0 111.534 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 17.9 mtm -68.33 -42.03 79.93 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.87 -16.32 57.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -67.71 -21.79 65.29 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.834 -0.541 . . . . 0.0 109.819 173.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.73 -28.86 65.04 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 173.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.96 -14.33 60.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 121.266 -0.174 . . . . 0.0 111.442 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -67.68 -1.05 4.6 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.123 0.42 . . . . 0.0 110.34 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -96.27 -10.15 28.61 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.207 0.603 . . . . 0.0 112.164 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -156.28 -1.1 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.181 0 CA-C-N 119.062 0.846 . . . . 0.0 112.74 -178.435 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 t . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.51 -37.49 85.16 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.389 -0.819 . . . . 0.0 110.817 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.19 -28.24 71.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -77.94 1.49 20.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.414 0.686 . . . . 0.0 111.443 179.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -130.2 -3.66 4.43 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.235 0.614 . . . . 0.0 111.71 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.4 mt -111.19 -25.71 9.57 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.519 -0.277 . . . . 0.0 111.157 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.429 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -64.0 -43.96 76.65 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 98.5 Cg_endo -74.4 -1.37 10.92 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.52 2.147 . . . . 0.0 113.156 -175.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -134.99 12.26 3.61 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.929 0.492 . . . . 0.0 110.637 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.418 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 43.1 tp -64.47 -39.54 42.36 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 124.847 1.259 . . . . 0.0 114.207 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 90.6 Cg_endo -77.9 -26.22 6.9 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 CA-C-N 120.666 1.274 . . . . 0.0 112.436 -172.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -51.52 -38.34 53.69 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.606 0.639 . . . . 0.0 111.981 -173.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.7 mt -67.54 -19.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -112.56 -32.55 6.43 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -73.98 -6.96 50.53 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.268 0.227 . . . . 0.0 111.235 -177.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -136.8 -13.35 1.69 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.728 0.411 . . . . 0.0 110.785 167.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -57.45 -33.57 66.61 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -59.86 -24.2 64.04 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 117.931 0.865 . . . . 0.0 111.848 177.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.76 0.94 57.46 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.254 0.622 . . . . 0.0 110.654 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -120.86 4.83 10.49 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.508 1.123 . . . . 0.0 110.474 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.9 p -139.22 -15.04 1.12 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.65 -2.99 87.64 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.456 -0.635 . . . . 0.0 113.146 177.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.6 t -159.95 136.06 8.71 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.243 1.022 . . . . 0.0 111.099 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -66.2 -19.09 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.37 -0.206 . . . . 0.0 111.344 175.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -75.34 -28.31 59.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 117.92 0.327 . . . . 0.0 110.198 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -78.11 -37.25 46.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.21 -29.99 75.05 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -69.55 -41.74 75.5 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.244 0.522 . . . . 0.0 110.887 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.29 -24.03 27.89 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 118.906 -0.569 . . . . 0.0 112.27 -175.37 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -72.77 -36.34 67.63 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 119.309 0.959 . . . . 0.0 109.925 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.6 t -64.89 -43.17 96.33 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 CA-C-N 117.856 0.298 . . . . 0.0 110.618 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -77.31 -28.39 53.22 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 121.279 -0.169 . . . . 0.0 111.266 -178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.48 -27.68 58.92 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.228 0.211 . . . . 0.0 110.589 175.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 53.0 m -63.95 -39.24 93.69 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.73 -45.9 56.32 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -58.31 -30.25 66.53 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.79 0.436 . . . . 0.0 111.773 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.56 0.45 22.96 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.794 0.438 . . . . 0.0 111.918 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.411 HD13 ' CD2' ' A' ' 46' ' ' PHE . 73.1 mt -124.72 -13.9 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 C-N-CA 123.909 0.884 . . . . 0.0 110.177 -177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.0 t -61.48 -14.45 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.312 0.645 . . . . 0.0 111.09 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.76 5.6 9.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.582 0.753 . . . . 0.0 110.562 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.83 51.75 0.77 Allowed Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 123.335 0.654 . . . . 0.0 111.51 -175.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.46 -8.01 19.5 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.176 2.584 . . . . 0.0 111.856 -178.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -82.1 3.37 27.22 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.956 0.902 . . . . 0.0 110.734 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -114.29 9.07 16.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.052 0.541 . . . . 0.0 111.316 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.411 ' CD2' HD13 ' A' ' 39' ' ' ILE . 1.0 OUTLIER -129.59 64.5 71.86 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 122.285 0.234 . . . . 0.0 110.489 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.91 170.5 15.4 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.923 3.082 . . . . 0.0 111.334 -178.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.417 ' C ' ' H ' ' A' ' 50' ' ' VAL . 31.1 mmm180 -125.62 12.8 8.04 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.934 0.894 . . . . 0.0 110.589 -177.082 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -73.35 18.78 0.11 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.47 1.108 . . . . 0.0 111.337 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.417 ' H ' ' C ' ' A' ' 48' ' ' ARG . 27.8 m -136.73 178.6 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 124.7 1.2 . . . . 0.0 109.511 -176.226 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -54.55 149.4 21.32 Favored Pre-proline 0 C--O 1.233 0.209 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.3 5.93 1.7 Allowed 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.144 2.562 . . . . 0.0 111.953 -176.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -128.16 -24.06 3.2 Favored 'General case' 0 C--O 1.228 -0.033 0 C-N-CA 123.764 0.825 . . . . 0.0 111.35 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.9 tp -66.99 -32.41 73.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.333 0.515 . . . . 0.0 110.287 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -72.91 -34.78 58.69 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.51 -43.22 90.78 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -73.97 -34.5 64.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.475 0.176 . . . . 0.0 111.475 -177.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 48.3 tpt85 -72.47 -37.43 68.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -174.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.0 mmm -76.8 -31.98 57.34 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.18 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -67.09 -35.03 78.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 174.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -64.46 -31.03 72.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.531 0.332 . . . . 0.0 110.236 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.02 -43.84 90.0 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.6 mm -72.98 -39.07 57.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 117.353 0.577 . . . . 0.0 110.099 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -68.25 -41.65 80.83 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.41 -0.181 . . . . 0.0 111.132 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.91 -32.64 74.03 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.186 0.448 . . . . 0.0 110.648 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.1 t -70.12 -25.94 63.72 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 117.515 0.143 . . . . 0.0 110.663 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.59 -36.02 17.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.493 0.317 . . . . 0.0 111.668 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.5 -15.81 61.79 Favored 'General case' 0 C--O 1.226 -0.14 0 O-C-N 121.973 -0.454 . . . . 0.0 110.522 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.96 7.6 8.64 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 111.471 177.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -130.79 -5.24 4.05 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.45 -9.9 3.49 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 114.747 0.659 . . . . 0.0 114.747 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -72.84 6.3 2.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.369 1.084 . . . . 0.0 112.489 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.1 24.0 0.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.516 1.126 . . . . 0.0 112.749 -174.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -154.1 168.61 25.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.253 0.621 . . . . 0.0 110.392 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.7 t 43.58 39.83 2.55 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.269 1.427 . . . . 0.0 112.47 -179.017 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.1 p -132.17 9.52 4.45 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.44 -14.47 61.26 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 85.8 p -163.72 166.32 22.26 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.798 -0.564 . . . . 0.0 111.969 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -146.1 23.19 1.36 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.091 0.957 . . . . 0.0 110.547 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -142.96 -179.35 6.31 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.109 0.564 . . . . 0.0 110.504 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -136.92 14.76 3.09 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.941 0.497 . . . . 0.0 111.51 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.44 -0.61 0.23 Allowed Glycine 0 CA--C 1.527 0.832 0 CA-C-O 119.516 -0.602 . . . . 0.0 114.061 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -152.2 8.56 0.48 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.386 1.093 . . . . 0.0 112.198 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -139.01 -28.98 0.78 Allowed 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.067 0.547 . . . . 0.0 109.99 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.29 67.69 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 174.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 10.5 p -67.03 -28.87 44.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-O 120.696 0.284 . . . . 0.0 110.318 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 0.74 51.78 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.34 0.656 . . . . 0.0 111.89 -177.206 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.89 -17.83 3.1 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-N 118.121 0.419 . . . . 0.0 111.815 176.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.14 -1.79 24.75 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.586 0.355 . . . . 0.0 110.679 174.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.538 ' O ' HD12 ' A' ' 91' ' ' LEU . 94.7 mtt-85 -128.58 -12.22 4.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.621 0.768 . . . . 0.0 111.564 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 90' ' ' ARG . 10.0 mp -131.15 24.11 4.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.5 1.12 . . . . 0.0 109.856 -174.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.0 7.26 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.384 1.474 . . . . 0.0 114.826 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -130.32 -0.15 4.55 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.879 0.763 . . . . 0.0 111.677 -177.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.3 ttm -67.09 147.67 52.86 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 122.079 -0.388 . . . . 0.0 110.514 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 32.1 m -65.85 140.74 97.36 Favored Pre-proline 0 CA--C 1.531 0.236 0 C-N-CA 123.444 0.698 . . . . 0.0 110.594 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 65.9 Cg_exo -53.63 2.89 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.474 1 C-N-CA 125.475 4.117 . . . . 0.0 116.313 177.3 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.2 tp -133.18 -20.03 2.17 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 119.056 0.844 . . . . 0.0 111.586 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.9 m -70.2 -19.4 63.17 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 122.051 -0.405 . . . . 0.0 110.919 176.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -65.47 -45.21 84.59 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.437 0.295 . . . . 0.0 110.973 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.401 ' H ' ' HG2' ' A' ' 100' ' ' GLN . 16.3 pt20 -83.26 -25.8 31.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.991 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.62 79.42 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.366 0.53 . . . . 0.0 109.785 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 tp -67.74 -37.59 82.38 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.994 0.518 . . . . 0.0 109.91 177.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 57.3 tp -66.27 -21.34 66.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 122.562 0.345 . . . . 0.0 110.729 177.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.44 HD12 ' HB2' ' A' ' 115' ' ' ALA . 0.2 OUTLIER -90.96 -14.98 30.52 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.207 0.603 . . . . 0.0 111.778 -177.38 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.9 p -134.49 4.86 3.42 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -173.199 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -123.68 -6.98 7.99 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 118.532 0.605 . . . . 0.0 110.771 174.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 21.7 mtm -143.25 0.6 1.18 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -175.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -135.48 -19.96 1.62 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.157 0.435 . . . . 0.0 111.786 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 59.97 17.41 43.8 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 119.118 -0.823 . . . . 0.0 114.501 172.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' PHE . . . . . 0.415 ' HB2' ' CD1' ' A' ' 104' ' ' LEU . 16.7 m-30 -68.67 162.32 26.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.119 1.46 . . . . 0.0 109.716 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 41.4 t -66.1 145.91 99.01 Favored Pre-proline 0 N--CA 1.456 -0.155 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 175.213 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.27 -20.39 14.76 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 122.893 2.395 . . . . 0.0 112.656 174.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.2 -31.13 65.6 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 122.44 0.296 . . . . 0.0 111.05 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -80.78 -36.31 31.98 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.44 ' HB2' HD12 ' A' ' 104' ' ' LEU . . . -66.23 -32.93 74.65 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.662 0.385 . . . . 0.0 110.517 175.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -72.46 -32.45 66.27 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 122.33 0.252 . . . . 0.0 110.823 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -73.76 -22.9 59.7 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 110.758 176.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 28.2 tp -84.26 -9.95 58.07 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -177.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.7 pt -135.25 11.75 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.386 0.539 . . . . 0.0 111.351 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 53.52 59.56 4.27 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.65 1.18 . . . . 0.0 113.96 176.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.4 m -137.77 -179.83 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 C-N-CA 123.683 0.793 . . . . 0.0 109.67 175.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -79.58 156.31 27.76 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.5 m -59.17 -37.27 76.96 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 122.141 -0.349 . . . . 0.0 110.77 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.3 t -72.58 -24.49 61.11 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.316 0.247 . . . . 0.0 111.38 -177.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -69.45 -39.76 77.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.726 -0.609 . . . . 0.0 109.794 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.1 t -64.25 -40.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.107 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -58.73 -37.13 75.51 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 122.929 0.143 . . . . 0.0 110.618 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.9 m -77.86 -38.79 45.28 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.2 mt -64.85 -36.06 83.12 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -177.59 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 32.2 m -82.86 -28.92 8.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.111 0 CA-C-N 118.343 0.52 . . . . 0.0 111.184 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 54.6 m -68.76 -38.98 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 117.843 0.292 . . . . 0.0 110.224 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -75.79 -27.63 58.05 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.597 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.57 -52.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.356 -0.215 . . . . 0.0 110.88 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -71.19 -22.35 62.04 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.41 78.63 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 175.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -74.94 -18.65 60.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.57 -0.252 . . . . 0.0 110.837 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 21.9 mm -74.93 -55.54 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 CA-C-N 118.371 0.532 . . . . 0.0 109.902 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -19.68 65.79 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.071 0.396 . . . . 0.0 111.793 -176.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.5 -22.07 62.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -162.98 -32.32 0.04 OUTLIER 'General case' 0 C--N 1.34 0.192 0 N-CA-C 115.278 1.585 . . . . 0.0 115.278 -170.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.468 0.431 0 C-N-CA 123.968 0.907 . . . . 0.0 112.163 -170.355 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 . . . . . 0 N--CA 1.456 -0.137 0 CA-C-O 119.693 -0.194 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -66.41 -29.02 69.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.384 0.538 . . . . 0.0 111.207 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.51 -34.74 79.83 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.89 -21.57 65.14 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 122.297 -0.531 . . . . 0.0 110.939 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.88 -36.29 21.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.92 0.391 . . . . 0.0 110.322 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -72.99 -45.82 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.869 0.468 . . . . 0.0 110.733 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.1 tpp85 -73.0 -27.4 61.76 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.002 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 46.8 t -66.52 -36.14 81.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.692 0.678 . . . . 0.0 110.311 177.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.26 -30.05 66.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.125 0.17 . . . . 0.0 110.965 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -91.29 -25.45 19.44 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 122.045 -0.41 . . . . 0.0 111.686 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -69.19 -37.47 78.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.668 0.667 . . . . 0.0 110.988 -178.59 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -63.22 -20.19 65.21 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 118.213 0.461 . . . . 0.0 110.677 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 9.4 m -86.72 -3.26 59.03 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.652 0.781 . . . . 0.0 111.207 175.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 81.4 mt -119.9 -8.5 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.619 -0.676 . . . . 0.0 111.366 -175.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -70.32 28.38 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.875 0.87 . . . . 0.0 112.122 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.1 179.2 7.04 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.571 -0.706 . . . . 0.0 111.371 -178.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -59.53 178.02 0.17 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.428 1.091 . . . . 0.0 113.543 -176.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -133.7 158.47 75.44 Favored Pre-proline 0 C--O 1.234 0.244 0 C-N-CA 124.175 0.99 . . . . 0.0 109.725 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -75.11 -179.82 5.39 Favored 'Trans proline' 0 N--CA 1.451 -1.018 0 C-N-CA 122.818 2.345 . . . . 0.0 110.357 176.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -148.43 -2.34 0.51 Allowed 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 177.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -66.15 -21.69 66.34 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 121.69 -0.631 . . . . 0.0 111.945 -177.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -67.09 -45.61 76.76 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.455 ' N ' HD22 ' B' ' 49' ' ' LEU . 3.2 mm? -75.98 -20.25 58.04 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.86 -21.4 66.46 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 122.323 -0.236 . . . . 0.0 110.534 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 64.6 mt -71.09 -26.43 63.05 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.329 -0.232 . . . . 0.0 110.44 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.49 ' C ' ' H ' ' B' ' 54' ' ' LYS . 48.6 mt -74.08 -17.28 60.97 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.954 178.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -69.04 17.94 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.065 0.393 . . . . 0.0 111.324 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.49 ' H ' ' C ' ' B' ' 52' ' ' LEU . 51.9 mtmt -118.47 -2.39 11.06 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.192 0.997 . . . . 0.0 110.931 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -153.83 -14.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.177 0 CA-C-N 118.353 0.524 . . . . 0.0 111.457 177.338 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t 59.26 170.29 0.07 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.609 1.164 . . . . 0.0 113.215 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp -72.33 -24.79 61.36 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.983 0.913 . . . . 0.0 111.525 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -61.57 -32.03 79.86 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.683 -0.636 . . . . 0.0 112.503 -175.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -75.49 1.44 14.15 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 117.74 0.77 . . . . 0.0 111.852 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -134.09 4.97 3.54 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.559 0.744 . . . . 0.0 110.169 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -111.87 -46.89 3.19 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.813 0.845 . . . . 0.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.441 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -60.37 -43.74 93.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -177.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.441 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 75.0 Cg_endo -73.06 -1.49 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.049 1.832 . . . . 0.0 112.495 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -135.03 7.79 3.45 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.02 0.528 . . . . 0.0 110.524 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.417 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 46.4 tp -57.92 -45.15 99.81 Favored Pre-proline 0 N--CA 1.451 -0.397 0 C-N-CA 124.354 1.061 . . . . 0.0 112.904 -178.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 89.2 Cg_endo -77.84 -10.18 16.88 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.935 1.757 . . . . 0.0 112.624 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -65.71 -20.13 66.17 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.953 0.797 . . . . 0.0 111.429 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.1 mt -75.97 -19.09 59.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.72 0.236 . . . . 0.0 110.88 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.28 -18.07 15.63 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.464 0.706 . . . . 0.0 109.666 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.07 -18.74 26.77 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 125.115 1.366 . . . . 0.0 111.231 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -140.39 -14.05 1.0 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 172.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.65 -28.22 71.13 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.21 -10.01 13.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.397 0.679 . . . . 0.0 111.812 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.21 6.31 4.92 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.367 0.667 . . . . 0.0 111.473 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 tp -106.22 -3.91 20.78 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.047 0.539 . . . . 0.0 110.342 178.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 t -147.84 -19.92 0.36 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.022 0.529 . . . . 0.0 111.439 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 22.81 78.67 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.566 -0.574 . . . . 0.0 113.849 172.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.8 t -146.06 134.77 22.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 118.227 1.014 . . . . 0.0 110.204 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -72.14 -26.49 62.12 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.71 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -73.43 -34.04 65.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -77.05 -39.76 48.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 177.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.23 -36.61 92.0 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -72.02 -36.5 69.69 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.667 0.734 . . . . 0.0 111.246 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -22.91 36.57 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.403 -178.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.94 -44.49 63.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.709 0.686 . . . . 0.0 110.357 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.36 -34.69 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-N 118.549 0.613 . . . . 0.0 110.967 -178.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.54 -32.08 47.77 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.937 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.76 -26.71 60.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 175.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 67.4 m -67.01 -37.57 84.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -43.92 44.23 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -62.67 -25.55 68.2 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.96 -0.463 . . . . 0.0 110.571 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.28 0.19 23.05 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.223 0.609 . . . . 0.0 111.648 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.03 -14.31 7.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.41 0.684 . . . . 0.0 109.99 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 38.2 t -58.3 -14.56 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 123.452 0.701 . . . . 0.0 111.527 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.06 2.28 9.28 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.053 0.541 . . . . 0.0 111.53 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.83 54.56 1.05 Allowed Pre-proline 0 CA--C 1.533 0.304 0 C-N-CA 123.008 0.523 . . . . 0.0 111.28 -177.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.08 -10.99 27.74 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.886 2.391 . . . . 0.0 112.479 -177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.97 -9.64 58.83 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.773 0.429 . . . . 0.0 110.906 176.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -96.93 7.21 47.14 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.4 0.68 . . . . 0.0 111.037 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -129.8 60.63 53.04 Favored Pre-proline 0 CA--C 1.533 0.293 0 C-N-CA 122.666 0.386 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.429 ' C ' ' HD3' ' A' ' 48' ' ' ARG . 92.3 Cg_endo -73.7 163.39 37.41 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.785 2.99 . . . . 0.0 111.109 178.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.429 ' HD3' ' C ' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -138.34 3.83 2.39 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.417 0.687 . . . . 0.0 111.072 179.432 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.45 -17.91 63.0 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 m -73.05 -49.14 40.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -164.59 152.3 10.39 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 126.545 1.938 . . . . 0.0 107.127 172.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.9 3.15 4.08 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 123.472 2.781 . . . . 0.0 112.449 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -136.0 -21.25 1.44 Allowed 'General case' 0 C--N 1.341 0.21 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -176.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.6 tp -68.76 -29.52 67.93 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.39 0.541 . . . . 0.0 110.989 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.29 -34.02 33.92 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.52 -42.45 92.28 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.114 0.457 . . . . 0.0 110.185 177.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -77.0 -31.8 56.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.22 -37.86 86.55 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.989 0.359 . . . . 0.0 111.634 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.2 mmm -80.52 -34.76 35.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.314 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -67.38 -42.43 83.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.322 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -72.49 -20.18 61.41 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.434 -0.506 . . . . 0.0 110.584 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.08 -40.36 95.06 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -70.89 -39.0 74.8 Favored 'Isoleucine or valine' 0 C--N 1.338 0.084 0 CA-C-N 117.447 0.624 . . . . 0.0 109.599 177.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -66.93 -40.17 87.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -23.55 62.21 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.415 0.286 . . . . 0.0 111.192 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.4 t -84.14 -20.18 32.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.16 0.184 . . . . 0.0 110.633 177.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.66 -49.14 13.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.379 -0.201 . . . . 0.0 111.385 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.7 p30 -75.2 -13.05 60.42 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.188 -0.32 . . . . 0.0 111.453 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.19 3.21 40.25 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.314 0.646 . . . . 0.0 111.517 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -139.61 3.36 2.08 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.95 0.5 . . . . 0.0 111.359 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.13 4.66 83.94 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 122.978 0.323 . . . . 0.0 112.823 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.48 1.85 18.02 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 117.499 0.65 . . . . 0.0 111.277 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.23 21.42 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.025 0.53 . . . . 0.0 110.608 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -145.6 -176.76 5.25 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.352 1.061 . . . . 0.0 109.084 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -56.62 155.72 7.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.919 0.488 . . . . 0.0 111.137 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.0 p -70.82 168.47 16.69 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.584 0.707 . . . . 0.0 111.895 -177.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -156.15 -166.85 2.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.309 1.043 . . . . 0.0 108.854 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 72.6 p -145.18 168.43 20.41 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.564 0.346 . . . . 0.0 110.98 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -143.06 20.27 1.94 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.256 0.622 . . . . 0.0 111.304 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -130.87 -166.27 1.67 Allowed 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 123.769 0.828 . . . . 0.0 109.882 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -142.39 11.41 1.91 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.75 16.01 0.06 OUTLIER Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.154 -1.022 . . . . 0.0 115.513 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.8 t -147.4 -3.04 0.56 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.173 1.487 . . . . 0.0 113.181 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.49 -31.34 0.11 Allowed 'General case' 0 C--N 1.334 -0.079 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -71.95 -20.17 61.78 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 171.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.3 p -70.24 -29.53 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.04 0.54 55.05 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.646 0.778 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -115.54 -49.02 2.76 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 124.164 0.986 . . . . 0.0 109.937 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.46 -2.17 6.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 112.462 -175.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.2 mtt-85 -128.77 -7.62 5.04 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.171 0.588 . . . . 0.0 111.77 -177.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 mt -140.3 21.99 2.39 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.182 0.593 . . . . 0.0 111.394 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.4 7.63 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.896 1.278 . . . . 0.0 114.078 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -130.2 -3.43 4.45 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.772 0.715 . . . . 0.0 112.649 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 53.4 ttm -73.79 142.65 46.19 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.493 HG23 ' H ' ' A' ' 98' ' ' SER . 12.4 t -61.89 147.35 89.86 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.38 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.59 1.2 0.06 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 125.217 3.945 . . . . 0.0 117.016 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 25.7 tp -129.19 -26.58 2.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.673 1.124 . . . . 0.0 112.739 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.493 ' H ' HG23 ' A' ' 95' ' ' THR . 73.9 m -68.89 -24.02 64.27 Favored 'General case' 0 C--N 1.337 0.062 0 CA-C-N 119.12 0.873 . . . . 0.0 109.751 175.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -72.66 -25.33 61.23 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 122.183 0.193 . . . . 0.0 110.758 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -80.82 -37.41 30.16 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 176.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.81 -29.96 70.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 176.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.22 -48.41 67.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.502 0.321 . . . . 0.0 110.445 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.411 ' C ' HD12 ' A' ' 103' ' ' LEU . 4.2 pp -73.83 -4.72 36.57 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.185 -0.322 . . . . 0.0 111.444 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.2 tp -103.05 -7.31 21.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.214 0.606 . . . . 0.0 112.22 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 82.5 p -140.63 2.05 1.77 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.5 8.51 5.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.807 0.443 . . . . 0.0 110.688 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 5.0 mtm -143.21 -2.7 0.98 Allowed 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.624 0.77 . . . . 0.0 112.338 -178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -139.95 -14.69 1.04 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.471 0.578 . . . . 0.0 112.072 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.56 8.31 25.54 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.015 176.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -63.87 154.81 32.54 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 118.265 1.032 . . . . 0.0 111.312 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 60.9 m -70.79 157.66 89.73 Favored Pre-proline 0 N--CA 1.456 -0.166 0 C-N-CA 123.172 0.589 . . . . 0.0 109.908 178.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -70.23 -16.16 35.5 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.801 2.334 . . . . 0.0 112.076 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.23 -45.01 43.01 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.234 0.47 . . . . 0.0 111.075 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -82.99 -23.61 33.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.39 -30.1 68.94 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 173.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.94 -32.6 63.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -70.28 -22.85 62.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.766 0.427 . . . . 0.0 110.611 175.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.0 tp -83.4 -7.55 59.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.415 HG13 HG22 ' A' ' 121' ' ' VAL . 23.5 pt -134.92 11.41 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.775 -0.578 . . . . 0.0 110.369 175.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 54.04 59.85 3.99 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.998 1.319 . . . . 0.0 113.364 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.415 HG22 HG13 ' A' ' 119' ' ' ILE . 33.5 m -138.0 -176.19 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 C-N-CA 124.702 1.201 . . . . 0.0 109.336 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -88.66 160.21 17.48 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.6 m -55.97 -40.83 73.84 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 122.745 0.418 . . . . 0.0 111.067 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.5 m -69.81 -20.72 63.44 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.926 0.491 . . . . 0.0 111.787 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.48 -34.38 54.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.424 0.556 . . . . 0.0 110.124 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.3 t -64.98 -36.65 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.061 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.49 -38.45 87.37 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.3 m -71.44 -40.55 70.32 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 119.678 -0.201 . . . . 0.0 110.696 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.02 -34.58 78.34 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.001 0.364 . . . . 0.0 111.82 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -81.17 -27.06 10.61 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.414 0.552 . . . . 0.0 111.032 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 61.6 m -68.95 -37.91 79.12 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -77.13 -25.52 52.18 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 122.275 -0.266 . . . . 0.0 110.658 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.67 -48.4 47.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.399 -0.188 . . . . 0.0 110.557 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.4 -22.61 61.85 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.723 0.238 . . . . 0.0 111.235 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.94 71.34 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.737 0.244 . . . . 0.0 110.371 177.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -75.57 -18.95 59.6 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.875 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.9 mm -78.61 -55.18 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.08 -23.26 67.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.677 0.217 . . . . 0.0 111.194 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.84 -24.35 62.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -158.96 -37.33 0.06 Allowed 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -171.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.7 p 45.63 -4.78 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 -169.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.18 4.15 0.06 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 121.002 1.728 . . . . 0.0 114.088 174.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 47.81 39.23 10.13 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.978 0.911 . . . . 0.0 113.174 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -56.07 -28.17 56.5 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -176.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -153.04 172.74 16.39 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.324 0.65 . . . . 0.0 109.984 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 55.5 tp -153.55 151.32 29.64 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.704 0.802 . . . . 0.0 108.984 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 4.9 p -152.48 90.22 3.74 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 120.91 0.386 . . . . 0.0 109.966 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.04 -8.12 18.65 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.257 2.638 . . . . 0.0 111.757 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 -72.95 170.42 14.85 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.193 0.597 . . . . 0.0 110.566 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 172.61 -12.49 0.04 OUTLIER Glycine 0 CA--C 1.529 0.965 0 CA-C-O 119.37 -0.683 . . . . 0.0 112.958 178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 50.8 m -149.55 167.37 26.49 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 117.944 0.872 . . . . 0.0 110.617 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -157.55 177.24 11.64 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.612 0.765 . . . . 0.0 110.187 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -150.44 170.21 19.62 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -151.32 28.39 0.65 Allowed 'General case' 0 CA--C 1.532 0.271 0 O-C-N 122.159 -0.338 . . . . 0.0 111.763 -174.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -137.74 18.45 2.87 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.889 -0.507 . . . . 0.0 111.914 -177.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 16.7 p-80 -139.89 8.25 2.31 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.103 -0.373 . . . . 0.0 111.747 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.0 p80 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 117.329 -1.32 . . . . 0.0 110.983 179.269 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' LEU . . . . . 0.414 ' C ' HD12 ' B' ' 2' ' ' LEU . 2.1 pp -151.96 -178.3 6.67 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.641 0.377 . . . . 0.0 110.759 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -149.54 169.1 21.71 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.464 0.705 . . . . 0.0 110.421 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.4 ' N ' HD23 ' B' ' 4' ' ' LEU . 2.0 pt? -154.87 154.59 29.25 Favored Pre-proline 0 N--CA 1.453 -0.304 0 C-N-CA 123.21 0.604 . . . . 0.0 110.661 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -74.01 172.58 15.64 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.419 2.746 . . . . 0.0 111.122 177.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.42 2.13 0.03 OUTLIER Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.711 -0.494 . . . . 0.0 112.48 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -153.72 167.29 30.11 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.868 0.834 . . . . 0.0 109.796 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -153.45 173.68 15.37 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.258 0.623 . . . . 0.0 110.319 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -152.38 172.82 15.9 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.086 0.554 . . . . 0.0 110.35 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -144.04 172.19 13.22 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.34 0.656 . . . . 0.0 110.428 -178.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -144.68 11.45 1.44 Allowed 'General case' 0 CA--C 1.527 0.073 0 C-N-CA 123.825 0.85 . . . . 0.0 111.033 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.16 174.07 13.2 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.786 0.834 . . . . 0.0 109.822 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 13.3 t -144.3 4.83 1.24 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.469 0.307 . . . . 0.0 111.767 -177.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 31.4 m 46.68 36.28 3.63 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.542 0.737 . . . . 0.0 112.37 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -140.84 170.3 16.01 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.545 0.738 . . . . 0.0 109.852 -176.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -140.3 167.62 21.71 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.522 0.729 . . . . 0.0 109.708 -176.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 58.8 m -139.37 159.68 64.98 Favored Pre-proline 0 C--O 1.232 0.15 0 C-N-CA 123.531 0.732 . . . . 0.0 110.157 -176.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -69.31 178.24 4.49 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 123.644 2.896 . . . . 0.0 111.446 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -147.28 -174.39 4.5 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.804 0.842 . . . . 0.0 110.736 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -145.05 147.77 32.95 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 173.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 2.0 t -139.65 21.94 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 122.928 0.491 . . . . 0.0 110.117 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -131.67 15.51 4.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.816 0.847 . . . . 0.0 110.296 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 22.2 m -138.16 20.93 2.8 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.214 1.005 . . . . 0.0 110.124 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -135.24 -19.58 1.7 Allowed 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.849 0.86 . . . . 0.0 111.287 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -139.72 7.0 2.28 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.171 0.989 . . . . 0.0 109.496 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.532 ' HG2' ' H ' ' B' ' 27' ' ' ASP . 17.8 ttp180 50.39 -164.49 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.751 1.221 . . . . 0.0 112.227 -178.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' ASP . . . . . 0.532 ' H ' ' HG2' ' B' ' 26' ' ' ARG . 8.7 p-10 -65.05 -8.4 16.07 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 123.708 0.803 . . . . 0.0 112.793 -177.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -62.82 -27.78 69.55 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.805 -0.559 . . . . 0.0 111.014 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.34 -37.46 62.97 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.46 -22.11 57.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.44 -0.447 . . . . 0.0 110.85 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.48 -44.23 68.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.856 0.36 . . . . 0.0 110.136 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 68.5 mt -73.71 -37.39 65.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 122.744 0.418 . . . . 0.0 110.095 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.25 -37.76 86.27 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.636 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.1 t -69.49 -37.19 77.11 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 117.74 0.246 . . . . 0.0 111.381 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.89 -30.35 71.45 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 120.545 0.212 . . . . 0.0 111.152 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -105.59 -6.58 19.17 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -67.7 -34.43 76.88 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -57.72 -33.76 68.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.441 0.697 . . . . 0.0 110.345 175.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 23.4 m -67.85 -12.47 60.7 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.183 0.593 . . . . 0.0 112.065 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 44.9 mm -110.2 -12.6 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 118.298 0.499 . . . . 0.0 111.165 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -77.62 25.36 0.19 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.194 0.598 . . . . 0.0 110.991 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -141.52 176.05 9.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.226 0.61 . . . . 0.0 111.374 -178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -66.14 178.06 1.25 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.526 1.131 . . . . 0.0 112.326 -177.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -138.25 156.88 73.51 Favored Pre-proline 0 CA--C 1.531 0.216 0 C-N-CA 123.96 0.904 . . . . 0.0 109.923 -178.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -74.55 176.15 10.11 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 123.058 2.505 . . . . 0.0 110.449 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -147.09 -2.21 0.62 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.16 -23.27 67.07 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.807 -0.558 . . . . 0.0 111.802 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.9 mtm -73.16 -35.27 66.42 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 49' ' ' LEU . 67.7 mt -81.55 -12.32 58.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.713 -0.617 . . . . 0.0 110.084 175.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.0 -20.66 61.68 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 171.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.0 -16.24 62.61 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.987 -0.446 . . . . 0.0 110.417 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.433 ' C ' ' H ' ' B' ' 54' ' ' LYS . 29.6 mt -90.51 -17.0 27.82 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 173.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -71.47 16.12 0.11 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.014 0.37 . . . . 0.0 111.468 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.433 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -133.8 9.35 3.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.184 0.993 . . . . 0.0 111.171 177.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 pp -153.83 -11.68 0.14 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -141.61 5.07 1.78 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.205 0.911 . . . . 0.0 113.262 -179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 7.6 tp -150.07 21.84 0.86 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.711 0.687 . . . . 0.0 111.54 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.19 158.95 33.92 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.356 -0.84 . . . . 0.0 110.857 177.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 51.4 tp -158.56 155.97 29.3 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 41.9 t -144.06 136.79 13.59 Favored Pre-proline 0 CA--C 1.531 0.235 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 178.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.71 177.02 8.08 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.554 2.836 . . . . 0.0 111.167 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 . . . . . 0 CA--C 1.532 0.258 0 C-N-CA 124.441 1.097 . . . . 0.0 111.735 -179.272 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 110.611 -0.144 . . . . 0.0 110.611 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.6 p -151.0 170.81 18.44 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.092 0.557 . . . . 0.0 109.712 177.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.77 -35.43 74.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 122.624 0.37 . . . . 0.0 111.251 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.75 -27.25 73.2 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 -176.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -73.89 -1.16 18.44 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.413 0.606 . . . . 0.0 111.421 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -135.37 4.31 3.15 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.407 0.683 . . . . 0.0 110.797 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tt -114.56 -41.25 3.45 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.975 0.51 . . . . 0.0 110.113 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.439 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.98 -44.65 99.79 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.5 Cg_endo -72.61 -2.49 11.91 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.092 1.861 . . . . 0.0 112.521 -178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -135.01 13.35 3.6 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.995 0.518 . . . . 0.0 110.97 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.431 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 45.9 tp -62.09 -39.57 59.35 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 76.8 Cg_endo -75.77 -11.69 20.1 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.665 1.577 . . . . 0.0 113.316 -176.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.405 ' CE1' HD11 ' B' ' 40' ' ' ILE . 47.8 m-85 -70.26 -22.8 62.84 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.66 0.663 . . . . 0.0 112.553 -173.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.0 -29.8 64.59 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 118.664 0.666 . . . . 0.0 109.59 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -80.51 -28.19 37.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.995 0.518 . . . . 0.0 109.8 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -56.29 -22.53 30.92 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.297 1.039 . . . . 0.0 112.171 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -140.27 -8.83 1.14 Allowed 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 117.812 0.278 . . . . 0.0 111.737 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.86 -28.45 73.06 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -72.29 -4.84 32.03 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.789 0.794 . . . . 0.0 111.655 177.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.45 6.3 5.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.192 0.597 . . . . 0.0 111.374 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.6 tp -99.9 -1.95 36.04 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.208 0.603 . . . . 0.0 110.193 177.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 t -148.05 -0.3 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.889 0.875 . . . . 0.0 110.754 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.98 -0.62 10.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.395 0.998 . . . . 0.0 114.919 173.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.7 m -139.18 134.37 32.69 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.176 1.488 . . . . 0.0 110.086 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -72.31 -23.57 61.19 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.002 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -65.19 -39.19 92.51 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 118.275 0.489 . . . . 0.0 110.501 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -83.43 -31.33 26.68 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.124 0.57 . . . . 0.0 110.127 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.2 -45.68 92.99 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -74.63 -26.4 59.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 117.388 0.594 . . . . 0.0 110.939 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.68 -46.38 72.48 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -64.76 -33.36 75.8 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 117.744 0.247 . . . . 0.0 111.117 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.77 -55.27 24.76 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 117.825 0.284 . . . . 0.0 110.656 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -74.5 -29.17 61.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.119 -176.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -25.04 63.58 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 119.789 -0.148 . . . . 0.0 110.984 177.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.88 -45.67 85.03 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 117.894 0.316 . . . . 0.0 110.231 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.6 tt -80.55 -36.45 33.01 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 119.839 -0.744 . . . . 0.0 111.564 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.94 -27.03 68.54 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.341 0.518 . . . . 0.0 110.242 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.45 -1.19 25.86 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.244 0.618 . . . . 0.0 111.662 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.0 mt -118.98 -13.56 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.725 0.81 . . . . 0.0 110.082 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -58.59 -12.31 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.694 0.798 . . . . 0.0 111.799 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.26 3.3 9.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.321 0.649 . . . . 0.0 111.42 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.41 55.26 1.03 Allowed Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.561 0.745 . . . . 0.0 110.531 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.87 -8.93 21.2 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.512 2.808 . . . . 0.0 112.759 -174.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -80.47 -8.58 59.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.776 0.43 . . . . 0.0 111.403 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -88.44 -17.18 30.97 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.294 0.237 . . . . 0.0 111.633 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.52 120.2 80.66 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -53.69 139.68 67.32 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.282 2.655 . . . . 0.0 112.389 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 54.3 mmm-85 -141.69 16.63 2.16 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.779 1.232 . . . . 0.0 110.084 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -128.17 20.85 6.3 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.95 0.9 . . . . 0.0 110.78 -175.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.2 m -139.37 -178.28 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 124.528 1.131 . . . . 0.0 108.999 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -53.79 146.96 24.75 Favored Pre-proline 0 CA--C 1.531 0.233 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.9 11.31 0.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 123.884 3.056 . . . . 0.0 111.676 -176.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -127.94 -22.21 3.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.631 0.773 . . . . 0.0 111.022 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.8 tp -74.42 -34.36 63.21 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.173 0.442 . . . . 0.0 110.251 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.71 -30.4 61.89 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.43 -43.58 93.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.203 0.601 . . . . 0.0 110.111 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -81.01 -29.78 35.08 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -177.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.24 -40.63 90.37 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 117.897 0.317 . . . . 0.0 111.129 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.3 mmm -74.94 -35.74 62.13 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -66.75 -35.91 81.21 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 117.529 0.149 . . . . 0.0 110.647 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -68.71 -27.36 65.88 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.866 0.466 . . . . 0.0 110.017 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.58 -37.32 84.96 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.593 -0.603 . . . . 0.0 111.593 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.7 mm -72.39 -38.91 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.067 0 CA-C-N 118.014 0.907 . . . . 0.0 110.323 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -69.74 -35.5 75.03 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.23 -0.294 . . . . 0.0 110.584 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.31 -28.15 66.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 122.166 -0.333 . . . . 0.0 110.58 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -80.34 -28.06 38.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.429 0.291 . . . . 0.0 110.878 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.63 -32.26 67.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.227 -0.295 . . . . 0.0 111.11 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -87.01 -12.49 47.26 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.406 0.282 . . . . 0.0 110.876 177.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.8 5.55 43.09 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.183 0.593 . . . . 0.0 110.877 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -134.99 1.75 3.03 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.27 0.628 . . . . 0.0 111.027 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.58 25.97 74.97 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-O 119.618 -0.545 . . . . 0.0 112.572 176.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -61.58 -16.35 47.31 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.847 0.823 . . . . 0.0 111.17 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.23 164.2 39.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.561 0.744 . . . . 0.0 110.305 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -141.35 4.27 1.78 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.844 0.858 . . . . 0.0 110.513 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.1 t -159.27 -172.15 3.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.254 1.021 . . . . 0.0 108.921 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 87.0 p -130.61 -19.0 3.06 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.225 -0.417 . . . . 0.0 111.609 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 58.04 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 174.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 74.2 m 57.41 168.72 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.899 1.28 . . . . 0.0 113.215 -171.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -149.7 16.26 0.88 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.466 0.706 . . . . 0.0 110.936 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.92 -176.39 4.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.925 0.49 . . . . 0.0 110.289 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -138.87 7.56 2.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.753 0.421 . . . . 0.0 111.857 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -172.51 12.42 0.04 OUTLIER Glycine 0 CA--C 1.529 0.918 0 CA-C-O 119.208 -0.774 . . . . 0.0 114.44 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.7 t -145.93 -0.63 0.8 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.845 1.322 . . . . 0.0 112.81 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -149.68 -45.92 0.13 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.08 -24.37 67.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.24 -28.59 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 O-C-N 122.117 -0.364 . . . . 0.0 110.545 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.63 -0.35 56.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.76 -21.09 2.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 118.168 0.44 . . . . 0.0 111.867 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -81.11 -1.94 46.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.071 0.548 . . . . 0.0 110.962 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.443 ' C ' HD12 ' A' ' 91' ' ' LEU . 74.5 mtp180 -129.19 -9.97 4.74 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.111 0.564 . . . . 0.0 111.734 -177.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.443 HD12 ' C ' ' A' ' 90' ' ' ARG . 10.8 mp -126.16 7.01 7.16 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.839 0.856 . . . . 0.0 111.43 -174.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.13 -9.31 1.96 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -75.21 -0.82 20.72 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.017 0.527 . . . . 0.0 111.225 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 72.0 mtm -121.13 162.48 20.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 122.94 0.496 . . . . 0.0 111.238 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 97' ' ' LEU . 28.6 m -67.29 144.21 97.95 Favored Pre-proline 0 N--CA 1.453 -0.303 0 C-N-CA 123.749 0.819 . . . . 0.0 110.585 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 53.9 Cg_exo -54.59 5.26 0.04 OUTLIER 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 124.829 3.686 . . . . 0.0 115.344 173.117 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.427 ' H ' ' C ' ' A' ' 95' ' ' THR . 3.3 tm? -123.71 -37.25 2.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.462 0.574 . . . . 0.0 110.086 -174.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 p -67.68 -20.79 65.33 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.307 0.503 . . . . 0.0 110.257 175.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 33.6 mtp-105 -71.7 -23.56 61.66 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.656 0.207 . . . . 0.0 110.839 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -78.99 -38.07 37.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -66.27 -29.78 70.07 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.41 ' C ' HD13 ' A' ' 102' ' ' LEU . 3.4 tm? -62.91 -51.3 67.47 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.86 -4.92 37.84 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 71.2 mt -95.3 -7.43 38.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.26 0.482 . . . . 0.0 111.951 174.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 65.1 p -136.07 8.12 3.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.558 0.617 . . . . 0.0 112.488 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.09 7.66 2.68 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.929 0.491 . . . . 0.0 110.847 176.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.5 tpp -136.05 -15.07 1.77 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -150.6 -21.81 0.23 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.437 0.562 . . . . 0.0 112.397 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 84.32 19.86 59.82 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 119.396 -0.669 . . . . 0.0 113.615 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -56.7 148.51 20.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.371 1.085 . . . . 0.0 110.708 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.3 m -72.68 153.41 91.49 Favored Pre-proline 0 CA--C 1.53 0.206 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -52.65 -30.11 44.34 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.459 2.773 . . . . 0.0 113.252 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.03 -33.9 72.59 Favored 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.749 -0.594 . . . . 0.0 110.808 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -83.26 -36.7 24.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.17 -31.04 68.34 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.916 -0.129 . . . . 0.0 111.24 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.32 -36.54 61.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.879 0.309 . . . . 0.0 110.794 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -69.41 -23.07 63.65 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.78 0.432 . . . . 0.0 111.211 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 23.6 tp -87.7 -3.29 58.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.981 0.512 . . . . 0.0 111.782 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.42 HG13 HG22 ' A' ' 121' ' ' VAL . 14.0 pt -134.38 10.66 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.986 -0.446 . . . . 0.0 110.793 178.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 59.43 50.89 7.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.444 1.098 . . . . 0.0 113.561 173.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.42 HG22 HG13 ' A' ' 119' ' ' ILE . 28.7 m -136.03 174.66 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 C-N-CA 123.482 0.713 . . . . 0.0 110.189 175.012 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.17 157.38 36.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.8 m -59.46 -36.58 76.24 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.138 -0.351 . . . . 0.0 110.99 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.7 t -74.28 -23.81 59.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.004 -0.435 . . . . 0.0 111.072 -179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.35 -42.5 65.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.963 -0.461 . . . . 0.0 110.621 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.4 p -68.11 -29.68 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.454 -178.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.23 -37.94 87.28 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 176.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 88.8 m -77.11 -36.53 55.52 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 122.382 -0.199 . . . . 0.0 110.488 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.14 -30.78 71.33 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.135 -0.459 . . . . 0.0 111.505 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.0 m -82.77 -27.69 8.31 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 118.903 0.774 . . . . 0.0 110.805 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 84.5 m -68.1 -38.71 82.6 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -76.7 -27.02 55.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 122.125 -0.359 . . . . 0.0 110.615 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.42 -49.06 45.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.23 -22.92 63.82 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 122.152 -0.342 . . . . 0.0 111.303 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.79 71.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -75.84 -18.9 59.28 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.532 -0.27 . . . . 0.0 111.105 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.0 mm -75.54 -55.38 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 118.402 0.546 . . . . 0.0 109.597 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -65.34 -18.42 65.3 Favored 'General case' 0 CA--C 1.527 0.083 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -75.19 -22.07 58.26 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.412 ' HG3' ' H ' ' A' ' 142' ' ' ARG . 15.9 pt20 -159.71 -37.45 0.06 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -171.087 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 20.0 p 43.41 24.97 0.06 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.822 0.849 . . . . 0.0 112.517 -169.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.412 ' H ' ' HG3' ' A' ' 140' ' ' GLN . 71.7 mtt85 -144.47 -5.66 0.74 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.242 0.617 . . . . 0.0 112.475 -172.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 50.51 9.36 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 96.4 mt -142.95 9.55 1.72 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.969 0.804 . . . . 0.0 112.167 -174.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -71.48 -34.53 70.26 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.362 0.528 . . . . 0.0 110.91 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 10.6 mp 46.48 -165.97 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.707 1.203 . . . . 0.0 112.278 -176.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 5.1 t -140.42 53.12 3.83 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 123.671 0.788 . . . . 0.0 110.014 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.34 171.76 17.0 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.395 2.73 . . . . 0.0 111.244 -177.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 90.2 mtm-85 -144.16 162.43 36.32 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 124.232 1.013 . . . . 0.0 109.361 178.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 173.14 27.73 0.02 OUTLIER Glycine 0 C--N 1.338 0.642 0 CA-C-O 119.528 -0.596 . . . . 0.0 113.126 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 14.9 t -144.27 177.87 8.31 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 118.094 0.947 . . . . 0.0 110.865 -177.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 57.0 -177.08 0.06 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.963 1.305 . . . . 0.0 112.383 -175.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 53.05 24.13 3.33 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.04 0.936 . . . . 0.0 111.987 -176.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.3 7.28 1.75 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.366 0.667 . . . . 0.0 111.417 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.31 6.3 0.98 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.373 0.669 . . . . 0.0 111.472 -179.32 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -150.17 8.66 0.64 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.188 0.595 . . . . 0.0 110.797 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 117.742 -1.123 . . . . 0.0 111.384 -178.82 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.477 0.902 0 CA-C-O 120.208 0.051 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 96.1 mt -141.44 31.46 1.7 Allowed 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 124.797 1.239 . . . . 0.0 108.792 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -133.94 14.96 3.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.375 1.07 . . . . 0.0 111.822 -171.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.427 ' H ' HD23 ' B' ' 4' ' ' LEU . 1.8 pt? -147.14 163.51 27.96 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.092 0.557 . . . . 0.0 110.88 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -53.23 167.53 0.76 Allowed 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 124.508 3.472 . . . . 0.0 114.203 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.22 175.17 44.27 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 179.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 52.27 19.39 1.09 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.256 1.022 . . . . 0.0 112.983 -178.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -142.9 19.1 1.97 Allowed 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.57 1.148 . . . . 0.0 109.865 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -136.51 18.41 3.12 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.084 0.953 . . . . 0.0 110.977 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -138.37 20.38 2.75 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.641 0.776 . . . . 0.0 110.263 -177.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.31 -6.18 13.18 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.684 0.794 . . . . 0.0 111.833 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -151.59 165.45 34.26 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.433 0.693 . . . . 0.0 109.781 178.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 66.3 m -148.81 178.92 8.24 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.591 0.756 . . . . 0.0 110.165 -177.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 43.7 m -60.66 168.69 2.11 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 123.338 0.655 . . . . 0.0 111.755 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -64.01 -5.81 5.25 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -177.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -92.95 -0.38 57.23 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.934 0.493 . . . . 0.0 111.055 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 16.0 t -153.04 55.27 1.37 Allowed Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 123.562 0.745 . . . . 0.0 110.251 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.93 173.09 11.64 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.42 2.747 . . . . 0.0 111.301 -177.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -148.79 175.37 11.3 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.121 0.568 . . . . 0.0 110.539 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -66.02 -4.83 7.92 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 17.2 m -144.86 176.99 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.109 0 C-N-CA 123.583 0.753 . . . . 0.0 110.164 178.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.9 pm0 -150.72 178.11 9.42 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.634 0.773 . . . . 0.0 110.041 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -143.99 169.03 18.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.052 0.541 . . . . 0.0 110.16 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt 48.17 31.1 2.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.078 0.951 . . . . 0.0 112.552 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -66.73 -5.31 11.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.432 0.693 . . . . 0.0 112.177 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 25.0 ptt-85 -148.35 171.69 15.6 Favored 'General case' 0 C--N 1.337 0.034 0 C-N-CA 123.58 0.752 . . . . 0.0 110.065 177.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -145.82 12.07 1.27 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.126 0.57 . . . . 0.0 110.879 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -59.35 -28.06 66.5 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.275 0.63 . . . . 0.0 112.017 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -69.07 -30.46 72.05 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.43 -15.73 48.54 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.738 0.769 . . . . 0.0 110.687 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.33 -46.31 16.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 mt -68.94 -38.7 79.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.695 177.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -67.69 -29.2 68.41 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.155 -0.45 . . . . 0.0 110.921 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.1 t -67.73 -44.45 77.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.728 0.695 . . . . 0.0 110.312 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.2 -24.41 67.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.248 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -107.44 -9.51 15.96 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -70.36 -36.07 73.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 173.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -69.2 -21.23 63.97 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.24 -0.288 . . . . 0.0 111.143 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 58.7 m -75.79 -10.8 59.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.274 0.629 . . . . 0.0 111.389 177.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.405 HD11 ' CE1' ' A' ' 13' ' ' PHE . 19.1 tt -123.94 30.03 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 122.181 0.991 . . . . 0.0 110.018 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -128.41 28.91 5.39 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.43 0.692 . . . . 0.0 109.574 176.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -142.46 -176.24 4.77 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.662 0.785 . . . . 0.0 110.279 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -60.34 178.79 0.18 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.07 0.948 . . . . 0.0 112.91 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.07 155.64 74.35 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.238 -175.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -76.8 59.09 6.24 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 124.499 3.466 . . . . 0.0 110.533 175.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -59.85 -9.51 2.99 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.609 0.764 . . . . 0.0 111.607 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -56.62 -23.37 40.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.242 0.617 . . . . 0.0 111.619 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 19.3 ptp -75.92 -29.08 58.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.844 -0.535 . . . . 0.0 110.813 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 49' ' ' LEU . 64.4 mt -80.39 -11.19 59.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 121.615 -0.678 . . . . 0.0 109.461 174.099 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.78 -20.29 61.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 168.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 50.4 mt -78.45 -8.53 58.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.432 0.293 . . . . 0.0 110.247 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -90.42 -18.77 24.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 171.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -74.24 13.7 0.53 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.665 0.386 . . . . 0.0 111.251 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -130.97 13.3 5.24 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.119 0.968 . . . . 0.0 109.894 174.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.3 mt -137.5 -26.87 0.97 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.533 0.733 . . . . 0.0 111.394 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.94 -15.14 37.37 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 117.884 0.311 . . . . 0.0 111.581 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.417 ' C ' HD12 ' B' ' 57' ' ' LEU . 1.0 OUTLIER -158.23 179.04 9.53 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.346 0.658 . . . . 0.0 110.424 179.518 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -155.14 168.1 28.16 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.038 0.535 . . . . 0.0 110.61 178.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 34.0 tp -146.55 -6.97 0.52 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.535 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 47.5 t -146.19 137.35 12.75 Favored Pre-proline 0 CA--C 1.532 0.261 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.88 167.8 24.85 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.167 2.578 . . . . 0.0 111.243 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? . . . . . 0 C--N 1.337 0.053 0 C-N-CA 124.029 0.932 . . . . 0.0 109.621 -178.097 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 mmt . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.4 m 60.53 177.54 0.1 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 124.444 1.098 . . . . 0.0 112.851 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.9 tp 61.43 -38.9 0.12 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.476 2.31 . . . . 0.0 114.847 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.6 -24.92 64.05 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 119.105 0.866 . . . . 0.0 112.51 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -68.85 -2.1 8.79 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 117.597 0.698 . . . . 0.0 111.126 177.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -131.01 -21.49 2.67 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.253 0.621 . . . . 0.0 110.974 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 tp -77.91 -44.87 25.74 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.138 -0.351 . . . . 0.0 110.36 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.418 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.29 -46.26 99.84 Favored Pre-proline 0 CA--C 1.534 0.346 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -173.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.418 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 88.4 Cg_endo -74.69 -0.24 9.57 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.307 2.005 . . . . 0.0 112.541 -176.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -133.65 13.29 4.07 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.411 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 42.2 mt -55.05 -43.54 99.12 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.411 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 69.5 Cg_endo -81.12 -12.54 11.74 Favored 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 121.919 1.746 . . . . 0.0 114.016 -170.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -66.03 -23.15 66.5 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 119.123 0.874 . . . . 0.0 111.843 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.417 HD12 ' N ' ' A' ' 14' ' ' LEU . 8.0 mp -69.76 -18.85 63.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 118.089 0.404 . . . . 0.0 110.557 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -98.27 -20.7 17.08 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -58.24 -22.26 51.57 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 123.682 0.793 . . . . 0.0 111.57 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -140.09 -24.93 0.81 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.247 0.219 . . . . 0.0 111.3 177.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -61.33 -29.0 70.27 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -65.47 -32.77 74.57 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.114 0.457 . . . . 0.0 110.635 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.47 -6.21 52.69 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.485 0.314 . . . . 0.0 111.833 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.0 mt -97.44 4.7 50.47 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -155.36 -15.8 0.11 Allowed 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.06 25.34 75.49 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.577 -0.702 . . . . 0.0 112.758 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.4 t -150.67 139.95 21.29 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.188 0.994 . . . . 0.0 110.948 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -81.16 -20.2 41.79 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.425 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -71.82 -36.54 70.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -76.63 -32.3 57.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.22 -43.31 89.55 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -67.92 -31.94 72.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 117.071 0.435 . . . . 0.0 110.633 178.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -71.27 -42.51 68.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.379 0.272 . . . . 0.0 110.406 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -65.3 -41.41 94.13 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.576 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.0 m -68.61 -37.7 78.0 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.127 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.327 -176.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -78.8 -29.8 45.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.577 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.32 -26.58 62.0 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.302 -0.259 . . . . 0.0 110.302 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.2 m -65.59 -40.82 93.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.428 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -75.45 -41.78 54.89 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 110.272 -0.269 . . . . 0.0 110.272 -176.814 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.92 -24.95 68.09 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.903 -0.498 . . . . 0.0 110.649 -178.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.75 0.46 26.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.39 0.676 . . . . 0.0 111.594 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.1 mt -122.41 -14.85 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.112 0.965 . . . . 0.0 109.977 -176.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.8 -14.83 7.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.463 0.705 . . . . 0.0 111.053 175.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.69 4.41 9.51 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.413 0.685 . . . . 0.0 110.933 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.74 53.05 0.89 Allowed Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.39 0.676 . . . . 0.0 111.295 -176.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -65.01 -10.72 26.62 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.24 2.627 . . . . 0.0 112.55 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -74.87 -13.84 60.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.53 0.332 . . . . 0.0 111.255 176.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -90.05 2.8 54.8 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.048 0.539 . . . . 0.0 111.533 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -133.77 65.08 69.84 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 122.483 0.313 . . . . 0.0 111.135 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -76.39 179.95 5.89 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 124.681 3.587 . . . . 0.0 111.396 -175.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 78.7 mmt-85 -132.56 16.42 4.4 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.662 1.185 . . . . 0.0 109.823 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -71.86 8.89 1.04 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.185 0.994 . . . . 0.0 110.902 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.63 178.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 C-N-CA 124.974 1.309 . . . . 0.0 108.693 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -53.73 146.09 27.88 Favored Pre-proline 0 CA--C 1.529 0.166 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -70.18 10.77 0.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.979 3.119 . . . . 0.0 111.983 -175.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -132.63 -17.53 2.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.325 0.65 . . . . 0.0 111.127 179.005 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 54.1 tp -75.93 -36.41 59.4 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.374 0.534 . . . . 0.0 110.558 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.81 -32.07 54.51 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -58.6 -42.84 89.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.768 0.827 . . . . 0.0 109.854 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 -79.61 -28.6 40.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -66.94 -41.27 87.26 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.242 0.474 . . . . 0.0 111.257 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 93.4 mmm -75.37 -32.27 60.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.241 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -68.67 -35.93 77.87 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.92 -26.86 67.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.773 0.429 . . . . 0.0 110.117 177.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.84 -38.36 65.69 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.7 mm -74.44 -35.98 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 CA-C-N 117.886 0.843 . . . . 0.0 110.046 177.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -67.68 -32.15 72.62 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.501 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.22 -32.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.937 -0.477 . . . . 0.0 110.207 175.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.1 t -73.22 -26.37 61.11 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.74 -30.86 51.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.334 0.253 . . . . 0.0 110.454 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -76.65 -15.12 59.9 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.107 -0.371 . . . . 0.0 110.314 173.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -93.05 7.58 43.54 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.608 0.763 . . . . 0.0 110.628 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -138.31 0.54 2.11 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.287 0.635 . . . . 0.0 111.39 -179.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.92 33.2 46.76 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.641 -0.533 . . . . 0.0 112.525 175.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -123.47 10.7 9.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.017 0.909 . . . . 0.0 111.253 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.73 24.28 1.53 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.874 0.469 . . . . 0.0 111.205 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -102.66 6.3 39.55 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.07 0.548 . . . . 0.0 110.809 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.8 t -155.08 174.37 15.27 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.497 0.719 . . . . 0.0 109.824 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -154.15 176.4 12.3 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.305 0.642 . . . . 0.0 110.816 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -145.94 -12.82 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.972 0.509 . . . . 0.0 112.009 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 m 61.5 168.16 0.1 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.663 1.185 . . . . 0.0 112.817 -173.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -144.69 14.42 1.56 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.03 0.932 . . . . 0.0 110.507 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.3 -179.3 6.75 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.919 0.888 . . . . 0.0 109.578 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -136.34 11.98 3.26 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.441 0.296 . . . . 0.0 111.707 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -164.27 12.08 0.09 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 119.394 -0.67 . . . . 0.0 113.827 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -149.78 7.91 0.66 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 1.127 . . . . 0.0 111.63 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -150.3 -48.24 0.13 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.35 -28.21 41.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 122.553 0.341 . . . . 0.0 110.819 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.8 0.76 55.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.096 0.558 . . . . 0.0 111.926 -178.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -121.48 -39.89 2.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.861 0.465 . . . . 0.0 110.012 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.35 -1.31 7.93 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -130.11 -2.95 4.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.221 0.608 . . . . 0.0 111.337 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 61.8 mt -137.52 20.17 2.91 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.918 0.887 . . . . 0.0 111.13 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.06 4.49 0.05 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -175.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -129.4 0.47 5.06 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.091 0.86 . . . . 0.0 112.085 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 54.5 ttm -71.55 149.55 45.61 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.8 m -57.43 140.11 79.92 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 123.648 0.779 . . . . 0.0 109.707 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.54 5.4 0.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.031 3.154 . . . . 0.0 113.919 -176.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.3 tp -128.97 -22.99 3.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.477 0.581 . . . . 0.0 110.682 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 71.0 m -69.32 -22.89 63.75 Favored 'General case' 0 N--CA 1.457 -0.075 0 O-C-N 121.891 -0.505 . . . . 0.0 109.922 174.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 40.4 mtp-105 -68.05 -32.54 72.96 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 175.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -76.39 -39.0 54.88 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.07 -30.45 71.52 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.1 tp -66.84 -46.59 74.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.402 0.281 . . . . 0.0 110.283 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.0 mt -74.89 -8.94 57.97 Favored 'General case' 0 N--CA 1.46 0.04 0 O-C-N 122.13 -0.356 . . . . 0.0 110.73 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -95.67 -8.4 34.83 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -140.65 -20.34 0.83 Allowed 'General case' 0 C--N 1.339 0.121 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.53 -10.85 58.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.121 0.873 . . . . 0.0 111.591 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 16.1 ptp -149.83 11.3 0.74 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -174.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -138.08 -13.13 1.42 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.856 0.753 . . . . 0.0 112.15 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.84 10.04 36.59 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.009 -0.884 . . . . 0.0 114.493 173.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -59.2 150.44 25.53 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 118.808 1.304 . . . . 0.0 110.132 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 94.4 p -67.87 157.19 87.44 Favored Pre-proline 0 N--CA 1.454 -0.235 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.246 179.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -69.45 -16.17 38.7 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 122.775 2.317 . . . . 0.0 110.866 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -79.16 -44.73 21.37 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.63 0.372 . . . . 0.0 110.733 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -78.67 -27.52 45.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.959 -0.463 . . . . 0.0 109.865 177.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.96 -27.64 64.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.905 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.64 -32.55 60.26 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 110.423 -0.214 . . . . 0.0 110.423 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -70.02 -28.95 65.91 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.635 0.374 . . . . 0.0 110.349 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 17.3 tp -76.87 -9.04 58.41 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 21.1 pt -134.98 12.29 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 117.931 0.332 . . . . 0.0 110.812 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 52.34 60.8 3.56 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.904 1.281 . . . . 0.0 113.7 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.36 -175.28 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.43 1.092 . . . . 0.0 109.492 175.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -88.4 160.64 17.48 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.8 m -56.32 -40.49 74.48 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 122.115 -0.365 . . . . 0.0 111.341 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 51.9 m -70.54 -20.54 62.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.688 0.395 . . . . 0.0 111.907 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.91 -37.7 62.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 121.954 -0.466 . . . . 0.0 109.834 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.63 -38.68 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.01 -33.02 74.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.79 -0.078 . . . . 0.0 110.79 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 91.4 m -78.12 -39.66 40.6 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -34.03 77.42 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 119.331 -0.366 . . . . 0.0 111.184 -179.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.5 m -80.49 -27.54 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 CA-C-N 118.515 0.598 . . . . 0.0 110.993 178.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.9 m -69.23 -38.78 78.7 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 178.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -76.04 -25.65 55.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.28 -47.85 46.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 117.674 0.216 . . . . 0.0 110.432 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.7 -22.77 65.25 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.337 0.517 . . . . 0.0 111.264 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -77.41 -34.38 54.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.91 0.386 . . . . 0.0 110.587 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -77.39 -27.46 52.49 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 123.366 0.666 . . . . 0.0 110.094 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.9 mm -66.66 -60.07 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.19 -23.69 67.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -171.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -71.9 -10.2 59.44 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -151.53 -50.07 0.12 Allowed 'General case' 0 C--N 1.34 0.19 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 42.9 p 43.57 -10.45 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 127.698 2.399 . . . . 0.0 117.371 -171.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.25 12.02 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 120.803 1.638 . . . . 0.0 113.788 -174.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -144.92 169.18 18.56 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.645 0.657 . . . . 0.0 112.02 -176.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -126.5 6.42 6.91 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.248 1.019 . . . . 0.0 109.641 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -79.94 21.17 0.57 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.324 1.049 . . . . 0.0 112.258 -174.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.463 HD23 ' H ' ' A' ' 147' ' ' VAL . 0.7 OUTLIER -137.9 165.17 27.17 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.109 -0.369 . . . . 0.0 110.694 -178.561 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.463 ' H ' HD23 ' A' ' 146' ' ' LEU . 29.0 m 39.26 48.7 1.97 Allowed Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 125.017 1.327 . . . . 0.0 113.585 -176.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -75.4 -7.25 18.64 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.192 2.595 . . . . 0.0 111.658 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ARG . . . . . 0.556 ' HG2' ' H ' ' A' ' 150' ' ' GLY . 36.8 ttt-85 -155.0 -170.98 3.67 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.271 0.628 . . . . 0.0 109.655 -178.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.556 ' H ' ' HG2' ' A' ' 149' ' ' ARG . . . -146.07 -172.99 16.91 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -177.395 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 80.9 p -139.51 16.23 2.55 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.862 0.465 . . . . 0.0 112.172 -175.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -71.77 4.48 3.22 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.014 0.526 . . . . 0.0 111.817 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 55.75 12.94 0.93 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.521 1.528 . . . . 0.0 114.329 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 33.3 p-80 -74.96 0.33 16.16 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.652 -0.655 . . . . 0.0 111.039 175.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.34 24.04 0.91 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.499 1.12 . . . . 0.0 110.765 -176.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -146.84 170.97 15.93 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.025 0.53 . . . . 0.0 110.141 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 64.9 m80 . . . . . 0 C--O 1.253 1.239 0 CA-C-O 117.461 -1.257 . . . . 0.0 110.155 -176.935 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.61 164.92 15.75 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.087 0.47 . . . . 0.0 109.754 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -147.18 1.59 0.74 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.509 0.724 . . . . 0.0 110.917 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.04 163.32 51.97 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 123.224 0.61 . . . . 0.0 110.383 178.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -53.41 -16.79 7.94 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.87 3.047 . . . . 0.0 113.537 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.93 170.97 40.05 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -158.07 175.05 14.3 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.277 0.631 . . . . 0.0 109.979 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -143.66 156.83 44.68 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 122.908 0.483 . . . . 0.0 110.154 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -157.11 8.71 0.18 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.227 0.611 . . . . 0.0 110.939 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' LYS . . . . . 0.461 ' HG3' ' H ' ' B' ' 11' ' ' LYS . 47.2 tptt -150.68 178.28 9.25 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.544 0.738 . . . . 0.0 109.483 -175.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.461 ' H ' ' HG3' ' B' ' 10' ' ' LYS . 21.4 tptm -129.31 16.3 6.07 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.736 0.815 . . . . 0.0 110.438 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.18 175.49 11.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.87 0.868 . . . . 0.0 109.605 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 93.2 p -148.88 -179.81 7.28 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 122.689 0.396 . . . . 0.0 110.892 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 48.1 m -140.19 27.47 2.14 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.462 0.705 . . . . 0.0 111.18 -175.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -129.41 7.0 5.31 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -71.03 -175.18 1.09 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.267 0.627 . . . . 0.0 110.185 174.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 56.4 m -134.52 156.35 78.87 Favored Pre-proline 0 CA--C 1.528 0.129 0 C-N-CA 122.943 0.497 . . . . 0.0 110.591 -176.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -73.12 178.65 6.27 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.971 3.114 . . . . 0.0 111.918 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -147.91 176.31 10.26 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.878 0.871 . . . . 0.0 110.278 -179.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -150.96 150.11 30.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 30.4 m -145.52 -176.36 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.035 0.934 . . . . 0.0 110.15 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -142.81 11.26 1.82 Allowed 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.969 0.508 . . . . 0.0 111.453 -176.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 16.1 m -143.64 -172.73 3.79 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.423 0.689 . . . . 0.0 109.884 -176.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -131.28 162.46 29.97 Favored 'General case' 0 C--N 1.339 0.109 0 CA-C-O 121.056 0.455 . . . . 0.0 111.681 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -155.26 13.49 0.37 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.139 0.976 . . . . 0.0 110.228 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -59.58 -17.17 30.68 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -171.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -144.66 -8.58 0.64 Allowed 'General case' 0 CA--C 1.527 0.061 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.7 tpt -67.02 -25.23 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.708 0.686 . . . . 0.0 110.707 178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.6 -29.55 65.52 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.14 -27.08 59.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 117.234 0.517 . . . . 0.0 110.549 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.67 -41.52 71.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.38 -43.01 70.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.013 0.525 . . . . 0.0 110.341 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -69.43 -29.79 67.59 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 119.041 -0.505 . . . . 0.0 111.246 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.2 t -65.9 -43.59 87.76 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 118.863 0.756 . . . . 0.0 110.191 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.56 71.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.595 0.236 . . . . 0.0 110.666 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -100.49 -3.13 31.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.183 -0.323 . . . . 0.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -70.42 -31.95 69.36 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -62.86 -33.0 74.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 172.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 20.6 m -81.22 -4.06 54.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.756 0.823 . . . . 0.0 113.101 -177.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 10.4 tp -119.54 -12.02 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 119.166 0.893 . . . . 0.0 112.262 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -83.18 -3.68 57.62 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.897 -0.502 . . . . 0.0 111.172 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.78 170.58 15.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.612 0.72 . . . . 0.0 111.799 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -71.89 -173.76 1.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.068 0.947 . . . . 0.0 110.284 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.9 m -131.58 149.46 73.56 Favored Pre-proline 0 C--O 1.232 0.161 0 C-N-CA 122.608 0.363 . . . . 0.0 110.114 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -76.5 -27.86 7.3 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.291 2.661 . . . . 0.0 113.437 -175.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.5 t70 52.53 -2.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.038 1.735 . . . . 0.0 115.138 -178.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -67.54 -17.04 64.5 Favored 'General case' 0 N--CA 1.457 -0.111 0 O-C-N 121.112 -0.992 . . . . 0.0 111.399 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 28.1 mtm -71.05 -31.25 67.64 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.324 -0.235 . . . . 0.0 110.401 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -85.87 -9.72 56.51 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.977 -0.452 . . . . 0.0 109.959 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -73.13 -20.21 60.97 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.708 -0.62 . . . . 0.0 109.552 169.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 80.9 mt -77.22 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.566 0.346 . . . . 0.0 110.245 173.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -88.51 -18.59 27.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.764 0.425 . . . . 0.0 109.957 171.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -77.89 18.07 0.52 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.196 0.598 . . . . 0.0 111.867 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -133.5 1.35 3.41 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.769 0.428 . . . . 0.0 111.919 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 pp -154.16 2.59 0.24 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.47 -0.11 0.57 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.605 0.639 . . . . 0.0 112.201 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 2.3 mt -156.51 159.08 38.26 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.064 0.546 . . . . 0.0 110.04 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -146.52 12.31 1.16 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.64 0.776 . . . . 0.0 110.634 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.1 tp -67.96 -10.61 54.83 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.278 0.631 . . . . 0.0 112.376 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 30.8 m -60.95 154.32 60.61 Favored Pre-proline 0 CA--C 1.531 0.242 0 C-N-CA 123.055 0.542 . . . . 0.0 111.36 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.41 171.07 18.45 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.388 2.726 . . . . 0.0 110.755 177.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 . . . . . 0 CA--C 1.528 0.097 0 C-N-CA 123.656 0.782 . . . . 0.0 110.084 179.112 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.8 ttp . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.4 p -142.51 25.08 1.87 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.132 0.573 . . . . 0.0 111.701 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.94 -35.63 66.86 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.79 0.436 . . . . 0.0 111.527 -178.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.53 -36.02 92.81 Favored Glycine 0 C--N 1.341 0.814 0 O-C-N 121.692 -0.63 . . . . 0.0 111.69 -177.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -73.77 1.87 9.54 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.612 0.765 . . . . 0.0 111.309 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -130.84 1.92 4.38 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.674 0.79 . . . . 0.0 110.955 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.34 -38.15 4.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.293 0.637 . . . . 0.0 109.865 177.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.446 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.29 -43.42 96.62 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.7 Cg_endo -73.34 -1.17 10.23 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.357 2.038 . . . . 0.0 112.867 -176.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -134.14 8.74 3.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.248 0.619 . . . . 0.0 110.409 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.75 -41.87 88.17 Favored Pre-proline 0 N--CA 1.452 -0.362 0 C-N-CA 125.362 1.465 . . . . 0.0 114.141 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.28 -10.76 14.84 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.818 1.679 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -66.94 -20.45 65.9 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.753 -0.592 . . . . 0.0 111.059 -177.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.0 mt -71.8 -21.63 61.68 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.095 0.407 . . . . 0.0 110.71 178.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -94.57 -22.19 18.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -55.8 -27.52 51.55 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 124.579 1.152 . . . . 0.0 111.674 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.9 p90 -140.09 -18.89 0.9 Allowed 'General case' 0 N--CA 1.458 -0.074 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.51 -25.74 74.63 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -81.8 -9.52 59.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.377 0.588 . . . . 0.0 110.978 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -109.4 -1.32 18.5 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.616 0.767 . . . . 0.0 110.497 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.5 tp -89.83 5.96 43.88 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.091 0.956 . . . . 0.0 109.444 175.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.2 p -142.28 -14.26 0.79 Allowed 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.696 0.799 . . . . 0.0 111.902 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.482 ' HA3' ' H ' ' A' ' 77' ' ' GLN . . . 64.04 13.86 54.27 Favored Glycine 0 CA--C 1.53 1.031 0 CA-C-O 119.619 -0.545 . . . . 0.0 112.965 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.5 t -142.06 133.25 26.24 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.887 0.843 . . . . 0.0 110.332 -178.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -70.54 -27.16 63.95 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.168 -177.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -75.03 -35.88 61.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.52 -0.112 . . . . 0.0 110.798 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -75.92 -32.4 59.58 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.504 -0.122 . . . . 0.0 110.894 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.3 -42.45 42.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -71.91 -27.89 63.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.591 0.696 . . . . 0.0 111.375 -177.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.71 -26.28 34.76 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.782 0.719 . . . . 0.0 111.747 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -73.8 -31.21 63.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.812 0.733 . . . . 0.0 109.897 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.411 HG12 ' SD ' ' B' ' 48' ' ' MET . 26.6 t -63.92 -51.88 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 177.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -73.99 -27.78 61.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.409 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.98 -25.09 61.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 117.461 0.118 . . . . 0.0 110.734 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 69.3 m -65.02 -45.37 85.81 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 119.093 -0.479 . . . . 0.0 110.327 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.438 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -72.88 -35.18 67.1 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.605 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -62.91 -23.95 67.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.532 -0.73 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.8 -0.1 33.11 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.82 0.448 . . . . 0.0 111.687 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 19.5 mm -110.87 -19.55 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.373 0.669 . . . . 0.0 109.494 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.68 -13.76 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 124.137 0.975 . . . . 0.0 113.076 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 2.24 9.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.859 -0.526 . . . . 0.0 111.181 -178.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -160.55 59.17 1.15 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 C-N-CA 123.136 0.574 . . . . 0.0 110.419 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -65.28 -10.72 27.02 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.441 2.761 . . . . 0.0 112.679 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -76.35 -13.12 60.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.963 0.505 . . . . 0.0 111.446 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -80.11 -22.62 41.94 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.044 0.383 . . . . 0.0 111.463 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -78.36 121.59 83.99 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -50.44 142.55 29.87 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.558 2.839 . . . . 0.0 112.998 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.0 mmt85 -134.98 8.94 3.52 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.934 0.894 . . . . 0.0 109.433 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -139.69 20.82 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.506 1.122 . . . . 0.0 110.819 -173.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 51' ' ' ASP . 4.5 t -133.4 170.57 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.418 ' H ' HG12 ' A' ' 50' ' ' VAL . 9.5 m-20 -53.26 144.54 29.53 Favored Pre-proline 0 N--CA 1.455 -0.209 0 O-C-N 122.127 -0.358 . . . . 0.0 110.604 -179.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.9 11.87 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 124.176 3.251 . . . . 0.0 112.008 -175.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -131.14 -27.08 2.06 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.378 0.671 . . . . 0.0 110.512 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.54 -36.86 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.05 -0.406 . . . . 0.0 110.261 177.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.13 -32.95 65.3 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -58.91 -45.25 90.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.283 0.633 . . . . 0.0 109.718 175.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -76.07 -25.92 55.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.895 -176.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -68.67 -42.54 77.74 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.534 0.607 . . . . 0.0 111.624 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 81.3 mmm -73.21 -33.52 65.42 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.488 0.585 . . . . 0.0 110.948 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -67.78 -38.92 84.01 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.495 177.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -66.86 -25.3 66.34 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.21 -36.92 71.57 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.3 mm -70.38 -41.02 78.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 117.794 0.797 . . . . 0.0 110.011 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -70.21 -34.03 72.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.643 -0.132 . . . . 0.0 110.643 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.35 -33.46 74.32 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.053 -0.404 . . . . 0.0 110.437 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.2 t -73.36 -30.63 63.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.14 -28.02 65.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.317 0.247 . . . . 0.0 111.024 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -89.43 -13.2 38.18 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.424 0.289 . . . . 0.0 110.934 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.84 2.03 47.44 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.011 0.525 . . . . 0.0 111.751 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -140.09 2.35 1.91 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.635 0.374 . . . . 0.0 111.275 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.05 85.68 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.944 -0.473 . . . . 0.0 113.228 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.16 -11.76 51.42 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 117.835 0.817 . . . . 0.0 111.668 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.09 135.7 12.48 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.416 0.686 . . . . 0.0 109.333 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -148.99 4.04 0.62 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.359 0.664 . . . . 0.0 111.368 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -158.43 -172.77 3.99 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.939 0.496 . . . . 0.0 110.159 -175.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.0 p -138.44 -177.27 4.78 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.536 0.734 . . . . 0.0 110.222 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLN . . . . . 0.63 ' HG2' ' H ' ' A' ' 78' ' ' SER . 33.7 tt0 -139.44 -170.03 2.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 122.862 0.465 . . . . 0.0 110.286 -174.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.63 ' H ' ' HG2' ' A' ' 77' ' ' GLN . 66.1 m -130.97 50.98 2.18 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.798 0.839 . . . . 0.0 110.311 -176.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -70.57 25.87 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.341 1.056 . . . . 0.0 112.225 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.452 ' H ' ' C ' ' A' ' 78' ' ' SER . . . -147.46 -178.78 6.43 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.944 1.298 . . . . 0.0 108.993 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.72 4.87 2.37 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -176.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.61 22.45 0.02 OUTLIER Glycine 0 CA--C 1.527 0.792 0 C-N-CA 120.27 -0.967 . . . . 0.0 114.279 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.4 t -146.93 -15.62 0.41 Allowed 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.668 1.234 . . . . 0.0 113.222 -177.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -141.22 -39.6 0.4 Allowed 'General case' 0 N--CA 1.461 0.104 0 O-C-N 121.694 -0.629 . . . . 0.0 109.729 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.11 -27.18 67.86 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 173.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.73 -24.71 36.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 122.815 0.446 . . . . 0.0 110.668 177.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.88 -0.74 57.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -177.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.62 -23.78 2.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.475 0.579 . . . . 0.0 111.757 174.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.31 -1.62 24.51 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.011 0.524 . . . . 0.0 111.298 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.432 ' C ' HD22 ' A' ' 91' ' ' LEU . 69.8 mtp180 -122.95 -11.59 8.09 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 122.972 0.509 . . . . 0.0 111.034 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.492 HD11 HD13 ' A' ' 137' ' ' ILE . 3.0 mm? -130.08 29.56 4.91 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.198 0.999 . . . . 0.0 110.325 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.97 10.39 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.655 1.182 . . . . 0.0 113.726 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.428 ' H ' ' C ' ' A' ' 91' ' ' LEU . 87.9 mmt-85 -130.08 0.18 4.69 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.413 0.685 . . . . 0.0 111.513 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.1 ttm -83.56 149.79 26.36 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.721 0.408 . . . . 0.0 110.432 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.1 m -63.52 138.97 97.51 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 123.722 0.809 . . . . 0.0 109.878 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.85 5.79 1.24 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.058 3.172 . . . . 0.0 113.364 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -121.3 -38.13 2.84 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.4 m -69.28 -24.23 63.93 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.835 -0.54 . . . . 0.0 109.955 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -70.73 -36.17 73.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.175 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -80.74 -24.1 38.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 118.613 0.642 . . . . 0.0 110.233 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.14 -33.91 76.47 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 173.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.5 tp -66.95 -41.17 87.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.6 mt -71.49 -5.09 30.5 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.527 0.331 . . . . 0.0 111.207 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 21.2 tp -111.81 -4.76 14.53 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.225 0.61 . . . . 0.0 112.216 -175.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -138.64 5.03 2.4 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -134.38 5.65 3.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.859 0.299 . . . . 0.0 111.518 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.3 mtm -136.91 2.43 2.6 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.637 0.775 . . . . 0.0 111.887 176.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -148.37 -19.64 0.33 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.566 0.621 . . . . 0.0 112.404 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 66.96 15.88 65.54 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-O 119.253 -0.749 . . . . 0.0 113.614 175.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -57.69 154.24 12.01 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.524 1.162 . . . . 0.0 111.453 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -63.31 146.35 96.27 Favored Pre-proline 0 N--CA 1.45 -0.448 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.554 175.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.37 -16.35 51.09 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 122.566 2.177 . . . . 0.0 111.364 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -73.99 -43.52 57.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.969 0.35 . . . . 0.0 110.268 178.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -78.09 -29.63 49.16 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.51 -28.82 67.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.913 -0.13 . . . . 0.0 110.812 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -74.32 -35.24 63.64 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -68.93 -26.26 64.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.659 0.384 . . . . 0.0 111.156 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -80.06 -9.07 59.67 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 18.4 pt -134.79 13.89 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 118.602 0.637 . . . . 0.0 111.371 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 58.97 53.07 5.84 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.683 1.193 . . . . 0.0 114.02 175.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.1 m -137.77 -175.69 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 C-N-CA 123.477 0.711 . . . . 0.0 110.057 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -91.88 162.31 14.48 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 175.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.1 m -58.62 -39.07 79.44 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 122.029 -0.419 . . . . 0.0 111.655 -177.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.8 p -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -74.58 -36.68 63.04 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 177.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.33 -38.05 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -61.79 -37.85 85.88 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.459 0.118 . . . . 0.0 111.001 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.5 m -75.45 -38.41 59.69 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 122.123 -0.36 . . . . 0.0 110.76 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -66.53 -31.97 73.03 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.389 -0.339 . . . . 0.0 111.727 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -82.19 -26.87 9.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 CA-C-N 118.689 0.677 . . . . 0.0 110.732 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 67.0 m -68.37 -35.85 78.33 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -78.22 -27.49 47.76 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.212 -0.305 . . . . 0.0 110.537 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.84 -42.52 70.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.278 -0.264 . . . . 0.0 110.666 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -75.58 -22.24 57.13 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.11 -0.369 . . . . 0.0 111.081 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.27 -36.64 69.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -73.72 -21.32 60.26 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 119.448 -0.311 . . . . 0.0 110.66 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.492 HD13 HD11 ' A' ' 91' ' ' LEU . 11.5 mm -74.14 -53.56 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.335 0.516 . . . . 0.0 109.665 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.95 -22.06 66.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.392 0.277 . . . . 0.0 111.634 -176.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -73.68 -24.89 60.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -157.64 -36.38 0.07 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -168.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 27.7 p 44.12 19.61 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.798 1.239 . . . . 0.0 114.236 -171.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.436 ' HG3' ' H ' ' A' ' 144' ' ' LEU . 20.6 ptt-85 -154.95 -13.85 0.12 Allowed 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -173.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 54.15 20.03 2.38 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 115.427 1.639 . . . . 0.0 115.427 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.436 ' H ' ' HG3' ' A' ' 142' ' ' ARG . 4.5 mm? -78.36 12.13 2.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 119.065 0.848 . . . . 0.0 110.816 173.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -140.27 169.16 18.2 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.993 0.517 . . . . 0.0 110.813 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -156.1 177.74 11.08 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.691 0.797 . . . . 0.0 110.18 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.427 HG12 ' H ' ' A' ' 149' ' ' ARG . 40.4 t -142.04 132.54 12.78 Favored Pre-proline 0 N--CA 1.455 -0.198 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.05 -16.01 1.55 Allowed 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 125.108 3.872 . . . . 0.0 115.102 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ARG . . . . . 0.563 ' HG2' ' H ' ' A' ' 150' ' ' GLY . 28.0 ttp180 51.19 -162.46 0.07 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.945 0.898 . . . . 0.0 111.158 -176.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' GLY . . . . . 0.563 ' H ' ' HG2' ' A' ' 149' ' ' ARG . . . -171.2 -179.34 42.27 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 78.5 p -147.05 9.49 0.98 Allowed 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.294 0.638 . . . . 0.0 111.395 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 58.22 13.22 2.23 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.738 1.215 . . . . 0.0 114.062 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -151.2 162.24 41.25 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 118.382 0.537 . . . . 0.0 110.811 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 52.5 p-80 -167.29 169.85 12.11 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.144 0.577 . . . . 0.0 110.67 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 51.5 t60 48.21 22.49 0.44 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.121 1.368 . . . . 0.0 114.24 177.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' HIS . . . . . 0.51 ' CD2' ' H ' ' A' ' 157' ' ' HIS . 10.1 t-160 -151.54 163.9 38.02 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.726 -0.609 . . . . 0.0 110.541 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' HIS . . . . . 0.51 ' H ' ' CD2' ' A' ' 156' ' ' HIS . 19.5 p-80 . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.116 1.366 . . . . 0.0 112.329 -177.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.5 mmt . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' LEU . . . . . 0.429 ' N ' HD22 ' B' ' 2' ' ' LEU . 3.1 mm? 51.33 27.0 3.34 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.362 1.065 . . . . 0.0 112.014 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -142.01 -0.81 1.28 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.818 0.447 . . . . 0.0 112.162 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -157.63 108.6 1.81 Allowed Pre-proline 0 N--CA 1.453 -0.313 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -49.76 141.27 28.25 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 124.526 3.484 . . . . 0.0 112.822 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 167.62 -178.4 41.58 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 111.691 -0.564 . . . . 0.0 111.691 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -153.5 159.16 42.19 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.664 0.786 . . . . 0.0 109.506 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -144.9 4.08 1.1 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.152 0.581 . . . . 0.0 112.445 -176.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -152.47 167.9 27.28 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.418 0.554 . . . . 0.0 111.234 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -156.28 163.53 39.42 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt 48.03 26.27 0.96 Allowed 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.366 1.066 . . . . 0.0 112.397 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.77 10.14 0.42 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.654 0.781 . . . . 0.0 112.627 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 68.7 m -144.23 15.28 1.67 Allowed 'General case' 0 C--O 1.232 0.139 0 C-N-CA 123.526 0.73 . . . . 0.0 110.708 -176.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 41.2 m -145.76 167.45 23.15 Favored 'General case' 0 C--N 1.338 0.105 0 C-N-CA 122.937 0.495 . . . . 0.0 110.224 -177.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -64.31 137.8 58.1 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -157.63 -172.11 3.83 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 124.16 0.984 . . . . 0.0 109.218 176.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 66.3 m -137.39 155.41 75.6 Favored Pre-proline 0 N--CA 1.456 -0.145 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -69.85 149.26 66.09 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.375 2.716 . . . . 0.0 111.177 -177.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.43 172.6 15.3 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.045 0.938 . . . . 0.0 109.426 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -64.94 2.52 0.71 Allowed 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 178.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 18.6 m -138.72 12.96 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 124.085 0.954 . . . . 0.0 111.062 178.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 74.7 mm-40 -141.26 5.71 1.89 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.615 0.766 . . . . 0.0 110.913 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 20.6 t -154.58 -179.93 8.45 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 122.809 0.443 . . . . 0.0 110.102 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -63.13 177.22 0.63 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.724 0.81 . . . . 0.0 111.235 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -131.25 0.87 4.15 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.055 0.542 . . . . 0.0 111.759 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 20.6 ptp180 -158.95 160.94 36.6 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 122.95 0.5 . . . . 0.0 110.738 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -154.39 -6.67 0.15 Allowed 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 123.392 0.677 . . . . 0.0 110.65 176.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -63.88 -24.2 67.65 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.116 -0.365 . . . . 0.0 110.776 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -73.86 -34.06 56.68 Favored Glycine 0 C--N 1.337 0.612 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.03 -21.55 63.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.265 0.533 . . . . 0.0 110.743 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.45 -41.16 20.17 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.77 -42.11 58.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.448 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -66.28 -33.34 75.52 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.841 -178.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.0 t -66.02 -42.66 89.34 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.475 0.58 . . . . 0.0 109.832 178.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -18.77 65.27 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -107.87 -12.47 15.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.082 -0.386 . . . . 0.0 111.571 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -69.18 -35.87 76.74 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -70.59 -23.13 62.52 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 57.9 m -70.92 -12.22 61.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.959 0.504 . . . . 0.0 111.435 175.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 38.5 pt -131.54 11.64 1.81 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.804 0.442 . . . . 0.0 111.641 -177.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -80.13 21.98 0.55 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.236 0.614 . . . . 0.0 110.553 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -137.7 -179.04 5.51 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.163 0.585 . . . . 0.0 111.107 -174.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -61.63 -179.9 0.21 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.066 0.946 . . . . 0.0 112.094 178.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.77 155.03 81.92 Favored Pre-proline 0 CA--C 1.528 0.113 0 C-N-CA 122.887 0.475 . . . . 0.0 110.016 -177.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -74.73 176.3 9.99 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.102 2.535 . . . . 0.0 110.78 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -146.46 -0.78 0.74 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.466 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -62.38 -24.38 67.34 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.004 0.521 . . . . 0.0 111.569 -179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' MET . . . . . 0.411 ' SD ' HG12 ' A' ' 32' ' ' VAL . 56.7 mtm -78.98 -37.11 40.2 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.577 0.351 . . . . 0.0 110.752 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -80.39 -17.02 53.09 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -69.02 -21.09 64.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.225 -0.297 . . . . 0.0 110.221 171.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -68.53 -20.56 64.57 Favored 'General case' 0 C--O 1.228 -0.052 0 O-C-N 122.024 -0.422 . . . . 0.0 110.03 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.432 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.6 mt -80.46 -21.38 42.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.214 173.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -75.18 10.92 1.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 172.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.432 ' H ' ' C ' ' B' ' 52' ' ' LEU . 37.6 ttpt -120.08 -1.27 10.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.822 1.249 . . . . 0.0 110.112 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -149.43 -13.91 0.29 Allowed 'General case' 0 C--N 1.34 0.184 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -126.64 20.1 7.24 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.293 0.637 . . . . 0.0 111.908 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 tt -144.37 139.76 28.65 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -156.73 172.62 18.29 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.654 0.782 . . . . 0.0 110.256 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -151.45 170.69 18.99 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.081 0.552 . . . . 0.0 110.907 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.3 p -153.02 139.35 12.33 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.76 170.09 20.42 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.12 2.547 . . . . 0.0 111.059 177.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 57.1 mmm-85 . . . . . 0 CA--C 1.528 0.128 0 C-N-CA 124.34 1.056 . . . . 0.0 109.941 -179.414 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 110.41 -0.218 . . . . 0.0 110.41 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.7 p -152.98 3.62 0.32 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -63.64 -12.43 33.68 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.57 -27.97 61.88 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -75.3 1.0 14.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.699 0.8 . . . . 0.0 111.193 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -132.27 -1.85 3.57 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.591 0.756 . . . . 0.0 111.262 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.482 HD21 ' CZ ' ' A' ' 46' ' ' PHE . 44.7 mt -111.81 -31.53 6.92 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.585 0.354 . . . . 0.0 111.052 176.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.412 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -71.39 -44.41 13.07 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 83.6 Cg_endo -76.73 -3.86 14.28 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.253 1.969 . . . . 0.0 112.834 -175.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -135.47 14.58 3.45 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 122.949 0.5 . . . . 0.0 110.643 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 16.4 tp -56.0 -39.74 79.66 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -174.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.39 -4.47 13.7 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.083 1.855 . . . . 0.0 112.667 -178.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -65.51 -23.29 66.85 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.665 0.666 . . . . 0.0 111.733 -176.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mp -74.49 -18.8 60.57 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.561 -0.712 . . . . 0.0 110.309 176.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -99.58 -27.92 13.46 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.589 0.356 . . . . 0.0 111.168 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -61.39 -15.67 38.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -140.41 -16.8 0.92 Allowed 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 174.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.46 -26.34 74.3 Favored Glycine 0 C--N 1.338 0.661 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -66.45 -37.63 85.58 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.014 0.907 . . . . 0.0 110.497 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.76 -16.07 54.79 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.529 0.331 . . . . 0.0 111.332 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.4 tp -79.53 -2.21 41.2 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.897 0.479 . . . . 0.0 111.952 -177.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.8 t -147.86 -16.78 0.36 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.907 -0.496 . . . . 0.0 112.333 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.33 11.55 85.4 Favored Glycine 0 CA--C 1.527 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 113.138 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.9 m -142.8 123.26 13.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.141 0.97 . . . . 0.0 110.12 -178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -66.73 -24.1 66.19 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.762 -177.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -68.72 -39.13 80.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.1 0.409 . . . . 0.0 110.891 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -82.36 -31.79 29.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.74 -43.72 95.85 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.57 -33.67 73.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.428 0.614 . . . . 0.0 110.546 178.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.3 -45.63 75.96 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 122.543 0.337 . . . . 0.0 110.968 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -64.13 -34.41 77.99 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.035 0.38 . . . . 0.0 111.032 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.36 -55.07 26.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 117.812 0.278 . . . . 0.0 111.116 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.1 ttp180 -75.51 -27.12 58.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.01 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.02 -26.74 64.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 117.499 0.136 . . . . 0.0 110.758 176.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.8 m -65.87 -38.09 87.88 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.432 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -73.7 -43.19 59.97 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -61.98 -18.57 60.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.848 0.459 . . . . 0.0 110.96 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -86.77 0.3 55.01 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.077 0.551 . . . . 0.0 112.078 177.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 77.6 mt -120.68 -20.9 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 122.724 0.41 . . . . 0.0 111.407 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.9 m -65.88 -4.5 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 118.832 0.742 . . . . 0.0 112.326 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.12 3.64 7.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.647 0.779 . . . . 0.0 110.31 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.0 56.29 1.26 Allowed Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.648 0.779 . . . . 0.0 110.303 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -64.99 -10.96 27.52 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.005 2.47 . . . . 0.0 111.782 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.26 -16.46 62.48 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.968 -0.457 . . . . 0.0 110.479 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -84.5 3.07 38.11 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.005 0.522 . . . . 0.0 110.909 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.482 ' CZ ' HD21 ' A' ' 7' ' ' LEU . 30.2 t80 -129.36 68.17 79.81 Favored Pre-proline 0 N--CA 1.454 -0.244 0 C-N-CA 122.408 0.283 . . . . 0.0 110.783 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.03 167.71 24.01 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.827 3.018 . . . . 0.0 110.746 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.2 11.28 11.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.82 7.55 3.05 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.072 0.949 . . . . 0.0 111.558 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 32.6 m -134.92 177.41 6.87 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.777 0.831 . . . . 0.0 109.911 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -59.32 151.23 59.99 Favored Pre-proline 0 N--CA 1.455 -0.22 0 C-N-CA 122.43 0.292 . . . . 0.0 110.291 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -70.64 12.71 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.063 3.176 . . . . 0.0 111.629 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -133.52 -17.61 2.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.438 0.695 . . . . 0.0 111.734 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 41.8 tp -74.45 -31.65 62.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.565 0.621 . . . . 0.0 110.198 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.91 -26.41 64.71 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -67.34 -42.17 83.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -79.87 -32.58 40.41 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.562 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -63.72 -44.81 92.51 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.632 0.651 . . . . 0.0 111.448 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.3 mmm -76.73 -33.4 58.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.01 -176.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -69.88 -33.31 72.07 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.477 177.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -67.53 -29.02 68.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.29 -37.98 71.19 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 49.5 mm -72.21 -38.25 61.71 Favored 'Isoleucine or valine' 0 C--O 1.23 0.074 0 CA-C-N 117.692 0.746 . . . . 0.0 110.267 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -69.52 -33.76 73.28 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.264 -0.272 . . . . 0.0 110.554 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.05 -33.11 73.06 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.106 -0.371 . . . . 0.0 110.262 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.2 t -73.06 -25.71 61.02 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.15 -36.5 61.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.169 0.187 . . . . 0.0 110.594 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -75.64 -23.86 56.38 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.3 -0.25 . . . . 0.0 110.452 176.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -72.6 2.14 6.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.262 0.625 . . . . 0.0 111.869 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -140.11 3.85 2.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.038 0.535 . . . . 0.0 111.001 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 72.19 13.95 76.57 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.82 -0.433 . . . . 0.0 112.524 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -69.14 -6.11 26.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 117.675 0.737 . . . . 0.0 111.454 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.28 159.83 43.2 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.062 -0.399 . . . . 0.0 110.69 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -148.69 -166.67 2.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.973 1.309 . . . . 0.0 108.76 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -57.63 173.23 0.3 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.116 0.566 . . . . 0.0 110.617 174.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.6 p -138.14 171.54 14.25 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.26 0.552 . . . . 0.0 111.996 -173.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -145.5 16.72 1.48 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.713 0.805 . . . . 0.0 110.67 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m 61.77 179.06 0.12 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.465 1.106 . . . . 0.0 112.642 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -141.39 25.78 2.02 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.882 0.473 . . . . 0.0 111.394 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.64 -173.63 2.79 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.714 0.806 . . . . 0.0 109.928 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.8 8.0 3.26 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -173.27 10.29 0.04 OUTLIER Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.643 -0.789 . . . . 0.0 114.446 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.6 t -148.38 9.09 0.83 Allowed 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.52 1.16 . . . . 0.0 112.269 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -154.02 -41.79 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.988 -0.445 . . . . 0.0 109.99 174.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.19 -23.09 64.8 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 121.65 -0.656 . . . . 0.0 109.808 174.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.43 -26.1 38.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 122.446 0.299 . . . . 0.0 110.364 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.64 -3.76 54.33 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.184 0.594 . . . . 0.0 111.845 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -129.75 -13.07 4.24 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.07 -1.92 31.47 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.098 0.559 . . . . 0.0 110.794 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.48 ' C ' HD22 ' A' ' 91' ' ' LEU . 86.6 mtt-85 -126.49 -15.62 5.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.489 0.716 . . . . 0.0 110.594 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.48 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.1 mm? -135.96 38.89 2.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.782 1.233 . . . . 0.0 110.204 -176.028 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.33 2.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -130.42 7.81 4.97 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.916 0.78 . . . . 0.0 112.333 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 tpp -61.86 142.78 57.16 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.014 0.37 . . . . 0.0 110.034 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 m -64.07 137.88 97.24 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.091 0.556 . . . . 0.0 109.665 178.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -68.81 5.5 1.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.905 3.07 . . . . 0.0 113.394 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -127.54 -33.67 2.3 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.5 m -67.84 -24.16 65.24 Favored 'General case' 0 C--N 1.337 0.057 0 O-C-N 121.858 -0.526 . . . . 0.0 109.951 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttm-85 -67.09 -32.52 73.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.671 0.388 . . . . 0.0 110.195 174.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -74.51 -37.48 63.09 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.34 -34.07 75.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 122.184 -0.322 . . . . 0.0 110.285 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.2 tp -65.96 -42.59 89.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.676 0.39 . . . . 0.0 110.947 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.13 -6.68 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.712 -0.617 . . . . 0.0 111.347 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -97.94 -4.9 35.45 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 175.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 69.4 p -134.84 3.37 3.22 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -140.16 10.43 2.35 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.246 0.475 . . . . 0.0 112.084 177.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.435 ' SD ' ' HB3' ' B' ' 32' ' ' LEU . 2.4 mtm -137.49 -8.9 1.69 Allowed 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -150.27 -9.01 0.28 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.012 0.824 . . . . 0.0 112.683 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 69.51 23.07 76.71 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.084 -0.842 . . . . 0.0 113.738 173.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -56.19 150.83 13.5 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.709 1.254 . . . . 0.0 109.98 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.4 m -66.07 155.61 86.75 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.3 -19.62 43.72 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 122.382 2.055 . . . . 0.0 111.357 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -73.57 -33.49 64.68 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.997 -0.439 . . . . 0.0 110.224 176.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -83.4 -37.91 22.65 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.31 0.244 . . . . 0.0 110.434 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.11 -27.4 68.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.213 -0.304 . . . . 0.0 111.03 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.16 -32.07 33.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 117.688 0.222 . . . . 0.0 110.721 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -71.4 -30.55 66.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.134 0.574 . . . . 0.0 110.836 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 58.6 mt -74.14 -5.77 43.72 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 176.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.0 pt -135.38 11.57 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 118.725 0.693 . . . . 0.0 111.289 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 55.06 54.55 8.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.516 1.126 . . . . 0.0 114.016 176.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.9 m -136.06 176.07 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.111 0.564 . . . . 0.0 110.266 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -74.38 157.3 35.93 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 88.4 m -60.97 -36.23 78.86 Favored 'General case' 0 N--CA 1.457 -0.106 0 O-C-N 122.193 -0.317 . . . . 0.0 110.81 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 95.6 p -75.94 -21.17 57.32 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.063 -0.398 . . . . 0.0 111.134 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -74.67 -43.29 55.98 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.087 -0.383 . . . . 0.0 110.413 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.63 -31.5 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 C-N-CA 119.481 -0.888 . . . . 0.0 110.063 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -63.67 -34.11 77.12 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.8 m -77.13 -37.59 53.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.222 -0.299 . . . . 0.0 110.422 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.03 -33.79 76.88 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.383 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.12 -26.86 9.21 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 118.314 0.506 . . . . 0.0 111.096 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.5 m -67.59 -38.5 84.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -78.34 -25.2 46.34 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 122.263 -0.273 . . . . 0.0 110.5 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.72 48.61 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.744 0.247 . . . . 0.0 110.342 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.79 -22.21 63.34 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.084 -0.385 . . . . 0.0 110.968 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.1 -36.41 69.45 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.387 -0.196 . . . . 0.0 110.967 176.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -83.79 -16.8 43.31 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.759 -0.588 . . . . 0.0 111.094 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 9.4 mm -62.24 -52.63 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.53 -17.31 60.76 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.88 -15.6 63.1 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -147.47 -44.4 0.17 Allowed 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 47.6 p 44.72 -12.3 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 118.759 2.874 . . . . 0.0 118.759 -177.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.19 7.09 0.09 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 121.354 1.888 . . . . 0.0 113.617 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.08 -173.92 4.37 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.899 0.48 . . . . 0.0 110.024 -175.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.404 HD23 ' H ' ' A' ' 144' ' ' LEU . 1.7 pt? -149.48 168.51 23.26 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.229 0.612 . . . . 0.0 110.472 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -155.0 164.22 39.21 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -178.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 41.0 tp -62.36 141.48 58.29 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.219 0.607 . . . . 0.0 110.149 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 18.5 m -147.99 152.56 40.47 Favored Pre-proline 0 C--O 1.232 0.163 0 C-N-CA 123.023 0.529 . . . . 0.0 110.074 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -75.46 -1.64 11.57 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 124.107 3.205 . . . . 0.0 112.157 177.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 -76.75 6.86 5.34 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 162.99 4.88 0.04 OUTLIER Glycine 0 CA--C 1.526 0.749 0 CA-C-O 118.935 -0.925 . . . . 0.0 114.296 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 39.8 m -142.31 2.44 1.47 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.957 1.379 . . . . 0.0 113.01 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -154.38 165.12 37.38 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.281 0.491 . . . . 0.0 110.316 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 25.7 p80 -157.5 167.85 29.0 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.095 0.558 . . . . 0.0 110.42 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 27.8 p80 -155.98 172.52 18.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.158 0.583 . . . . 0.0 110.262 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -146.06 22.01 1.39 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.374 0.669 . . . . 0.0 111.185 -176.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -140.5 20.38 2.38 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.738 0.415 . . . . 0.0 111.676 -174.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 . . . . . 0 C--O 1.251 1.167 0 CA-C-O 117.739 -1.124 . . . . 0.0 110.748 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 16.2 tpt . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 54.5 tp -152.87 -26.88 0.15 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.626 0.371 . . . . 0.0 110.781 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -151.82 -7.33 0.23 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.703 0.401 . . . . 0.0 111.577 178.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -155.52 150.44 20.63 Favored Pre-proline 0 N--CA 1.453 -0.29 0 C-N-CA 123.493 0.717 . . . . 0.0 110.594 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.19 5.96 5.04 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 124.601 3.534 . . . . 0.0 112.616 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -128.05 -166.51 12.06 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 -174.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -141.34 172.97 11.95 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.715 0.806 . . . . 0.0 110.392 -177.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -139.75 10.21 2.43 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.07 0.548 . . . . 0.0 111.439 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -150.87 177.36 10.2 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.897 0.479 . . . . 0.0 110.553 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -144.85 20.97 1.63 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.484 0.713 . . . . 0.0 110.911 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -134.73 2.58 3.18 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.545 0.738 . . . . 0.0 111.623 -177.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -143.81 8.65 1.5 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.623 0.769 . . . . 0.0 110.246 176.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -152.94 171.76 17.83 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.331 1.052 . . . . 0.0 109.237 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 34.3 t -154.05 172.6 17.25 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.02 0.528 . . . . 0.0 110.348 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -138.96 7.79 2.49 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.785 0.834 . . . . 0.0 110.907 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt 51.42 -167.11 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.458 1.103 . . . . 0.0 112.234 -177.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 48.7 m -140.49 54.12 4.68 Favored Pre-proline 0 CA--C 1.53 0.178 0 C-N-CA 123.406 0.682 . . . . 0.0 111.139 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.81 176.58 8.06 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.767 2.978 . . . . 0.0 111.134 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -148.66 168.09 23.76 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.447 0.699 . . . . 0.0 110.406 179.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -155.58 153.66 30.49 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 30.9 m -145.25 -173.7 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 C-N-CA 123.897 0.879 . . . . 0.0 109.632 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mp0 -131.28 1.79 4.2 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.825 0.45 . . . . 0.0 111.697 -176.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 25.2 m 51.11 21.32 1.02 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.111 0.965 . . . . 0.0 113.43 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -139.6 6.97 2.3 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.63 0.772 . . . . 0.0 110.871 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -72.01 2.11 6.22 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.531 0.732 . . . . 0.0 111.527 177.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.414 ' HG2' ' H ' ' B' ' 28' ' ' MET . 43.0 ttm180 -58.28 143.0 46.13 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.685 0.794 . . . . 0.0 110.303 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -68.2 -8.97 43.49 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' MET . . . . . 0.414 ' H ' ' HG2' ' B' ' 26' ' ' ARG . 17.6 tpt -63.08 -25.76 68.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.908 0.322 . . . . 0.0 111.46 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.02 58.72 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.71 -16.04 62.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.238 -0.566 . . . . 0.0 111.014 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.12 -39.24 18.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.435 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 63.2 mt -74.43 -38.07 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.937 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -68.26 -33.69 74.83 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.175 -0.44 . . . . 0.0 110.471 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.5 t -66.24 -36.5 83.17 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.665 0.666 . . . . 0.0 110.622 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.65 -32.09 73.47 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.584 0.231 . . . . 0.0 111.014 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -97.96 -11.38 23.14 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 68.7 tp60 -71.36 -36.68 71.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 121.899 -0.501 . . . . 0.0 110.196 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -64.63 -24.35 67.56 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 120.311 -0.555 . . . . 0.0 110.835 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 13.1 m -70.17 -12.62 61.73 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 111.382 0.141 . . . . 0.0 111.382 174.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 67.6 mt -107.16 -18.05 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 O-C-N 121.96 -0.463 . . . . 0.0 110.785 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.51 26.64 0.1 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.575 0.75 . . . . 0.0 112.054 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -142.06 176.5 8.91 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.058 0.543 . . . . 0.0 111.151 -178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -63.35 175.31 1.01 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.865 0.866 . . . . 0.0 111.362 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.94 155.12 80.51 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 122.407 0.283 . . . . 0.0 110.481 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' PRO . . . . . 0.451 ' C ' ' H ' ' B' ' 47' ' ' GLU . 51.5 Cg_exo -54.79 -39.55 89.15 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.681 2.921 . . . . 0.0 114.952 -174.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.8 t70 51.37 -11.18 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.473 1.909 . . . . 0.0 115.286 -174.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.451 ' H ' ' C ' ' B' ' 45' ' ' PRO . 14.1 pt-20 -66.53 -16.51 64.2 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.131 -0.981 . . . . 0.0 111.65 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 29.6 mtm -73.3 -32.25 64.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.274 -0.266 . . . . 0.0 111.044 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -84.24 -12.27 55.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.793 -0.567 . . . . 0.0 110.018 173.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.21 -20.61 62.24 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.837 -0.539 . . . . 0.0 109.649 169.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 75.9 mt -78.55 -13.58 59.76 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.337 0.255 . . . . 0.0 110.406 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -88.13 -16.0 34.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -75.55 6.85 4.22 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.845 0.858 . . . . 0.0 111.675 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -127.66 9.77 6.53 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.732 0.813 . . . . 0.0 111.566 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 pp -145.21 -17.33 0.49 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.44 170.28 9.28 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.807 0.337 . . . . 0.0 110.78 173.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 47.5 tp -152.06 158.79 43.51 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -142.76 162.14 36.25 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.055 0.542 . . . . 0.0 109.771 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 22.5 tp -152.32 7.72 0.45 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 122.756 0.422 . . . . 0.0 110.896 -179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.6 p -150.59 142.38 15.49 Favored Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.32 177.8 6.24 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.393 2.728 . . . . 0.0 111.351 176.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 . . . . . 0 CA--C 1.532 0.27 0 C-N-CA 124.59 1.156 . . . . 0.0 111.817 -177.647 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.2 ptm . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 120.366 0.127 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.9 t -154.15 164.71 38.07 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.867 0.467 . . . . 0.0 109.879 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.3 tp -59.22 -28.57 66.8 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.038 0.535 . . . . 0.0 110.967 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.45 -31.5 80.97 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.938 -0.465 . . . . 0.0 111.938 -178.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -77.17 1.42 18.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 122.719 0.408 . . . . 0.0 111.265 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -133.07 3.57 3.71 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.189 0.595 . . . . 0.0 110.695 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.6 tp -111.69 -41.1 4.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.542 0.337 . . . . 0.0 110.45 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.415 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.16 -45.23 99.88 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 98.9 Cg_endo -74.86 -0.39 9.84 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.431 2.087 . . . . 0.0 112.774 -176.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -135.13 14.04 3.55 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 68.3 mt -54.33 -44.31 98.57 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.574 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -81.47 -10.01 12.25 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.07 1.847 . . . . 0.0 112.672 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.57 -24.52 66.36 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 118.646 0.657 . . . . 0.0 110.621 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.2 mt -67.4 -18.92 65.31 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.67 0.271 . . . . 0.0 110.442 176.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -98.81 -14.65 19.58 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.462 0.705 . . . . 0.0 110.276 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -16.24 53.78 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.438 0.695 . . . . 0.0 111.097 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -141.59 -21.02 0.74 Allowed 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.52 -23.24 77.76 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -71.87 -10.02 59.16 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 117.657 0.729 . . . . 0.0 111.647 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.08 6.1 5.39 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.74 0.416 . . . . 0.0 111.466 -177.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -91.95 -0.96 57.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.098 0.559 . . . . 0.0 110.437 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 t -151.37 -4.95 0.28 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.44 18.08 71.28 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.44 -0.788 . . . . 0.0 114.096 173.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 t -143.81 131.24 21.0 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 118.344 1.072 . . . . 0.0 110.16 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -74.67 -22.94 58.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.181 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.57 -35.53 58.13 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -73.88 -35.77 64.74 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.0 -36.57 86.38 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.64 -35.69 75.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.222 0.511 . . . . 0.0 111.323 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.8 24.07 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.753 -176.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -65.18 -35.98 82.79 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.295 0.952 . . . . 0.0 109.427 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 24.6 t -62.91 -53.52 45.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 C-N-CA 122.338 0.255 . . . . 0.0 110.687 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -71.58 -28.12 63.61 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.43 -175.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.02 -21.59 59.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 122.201 0.2 . . . . 0.0 110.748 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 m -66.37 -44.88 81.92 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -38.1 64.2 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.964 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -67.32 -14.56 63.03 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.803 -0.561 . . . . 0.0 110.923 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.4 0.4 56.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.324 0.65 . . . . 0.0 111.216 174.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 88.3 mt -123.57 -14.27 5.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 123.523 0.729 . . . . 0.0 111.358 -174.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -60.07 -4.79 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 121.503 -0.748 . . . . 0.0 112.964 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.3 2.1 8.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.024 0.53 . . . . 0.0 111.143 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.32 54.74 0.86 Allowed Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 123.651 0.781 . . . . 0.0 110.544 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.7 -13.04 36.83 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 123.435 2.757 . . . . 0.0 113.049 -174.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -74.99 -14.97 60.68 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.463 0.305 . . . . 0.0 111.213 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -77.74 -19.79 54.56 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.007 -0.433 . . . . 0.0 111.016 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.46 114.55 52.33 Favored Pre-proline 0 N--CA 1.452 -0.345 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.87 155.09 71.12 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.526 2.151 . . . . 0.0 110.986 -176.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -136.8 12.85 3.15 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.771 0.828 . . . . 0.0 110.772 -174.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -134.73 27.93 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.343 0.657 . . . . 0.0 111.041 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.6 m -134.76 179.15 4.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 123.828 0.851 . . . . 0.0 109.207 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -54.43 146.72 31.79 Favored Pre-proline 0 CA--C 1.531 0.212 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -70.79 9.71 0.73 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.826 3.017 . . . . 0.0 111.722 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -129.37 -16.88 3.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.5 0.72 . . . . 0.0 110.933 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.8 tp -78.84 -34.17 45.37 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.165 0.439 . . . . 0.0 110.303 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.64 -31.28 60.79 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.54 -47.67 77.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -74.75 -30.0 61.34 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 119.698 -0.191 . . . . 0.0 111.485 -177.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -63.05 -45.91 89.99 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 118.382 0.537 . . . . 0.0 110.605 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 92.9 mmm -73.54 -31.3 63.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.829 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.37 -37.9 74.65 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.036 0.38 . . . . 0.0 111.016 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -65.71 -24.82 67.07 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.29 -37.22 63.24 Favored Glycine 0 C--N 1.339 0.721 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.5 mm -73.19 -39.93 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 CA-C-N 117.709 0.755 . . . . 0.0 110.432 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -68.27 -33.64 74.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.293 -0.254 . . . . 0.0 111.122 -177.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.32 -31.54 68.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 117.78 0.264 . . . . 0.0 110.433 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.2 t -75.97 -26.1 56.46 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.146 0.178 . . . . 0.0 110.835 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.58 -36.79 68.26 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.382 0.273 . . . . 0.0 110.991 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -77.15 -22.81 52.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.55 3.64 18.21 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.259 0.624 . . . . 0.0 111.747 177.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -138.86 2.91 2.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.846 0.458 . . . . 0.0 111.242 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.43 26.62 72.95 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 119.684 -0.509 . . . . 0.0 113.133 175.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.63 -10.15 17.3 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.164 0.982 . . . . 0.0 112.249 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.65 158.5 38.42 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.057 0.543 . . . . 0.0 110.363 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -144.52 5.73 1.23 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.344 0.657 . . . . 0.0 110.769 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.0 t -156.69 178.09 10.73 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.071 0.548 . . . . 0.0 109.956 -177.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.5 p -145.43 17.24 1.51 Allowed 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.528 0.731 . . . . 0.0 110.619 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -56.42 150.32 15.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.11 0.564 . . . . 0.0 110.278 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -144.84 -176.27 5.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.22 0.608 . . . . 0.0 109.855 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -141.21 13.12 2.2 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.782 0.433 . . . . 0.0 111.697 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.82 156.92 13.2 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.062 -0.398 . . . . 0.0 110.835 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.42 -11.94 59.91 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -175.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 156.19 26.04 0.03 OUTLIER Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.305 -0.719 . . . . 0.0 113.787 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.7 t -138.05 13.48 2.86 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.602 1.201 . . . . 0.0 112.111 -177.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -155.16 -50.04 0.09 Allowed 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -20.75 64.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.477 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.56 -29.96 47.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 122.465 0.306 . . . . 0.0 110.828 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.23 -2.05 54.63 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.822 0.449 . . . . 0.0 111.564 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -116.04 -44.62 2.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.58 0.352 . . . . 0.0 110.776 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.7 -1.61 1.99 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.468 ' C ' HD22 ' A' ' 91' ' ' LEU . 82.6 mtt-85 -120.82 -15.38 8.36 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.424 0.69 . . . . 0.0 111.516 178.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.468 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.1 mm? -134.32 28.23 3.73 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.909 0.884 . . . . 0.0 110.626 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.88 1.07 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -130.85 0.29 4.29 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.641 0.655 . . . . 0.0 112.097 -175.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.7 ttm -59.14 152.02 21.35 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.6 m -53.46 137.76 50.69 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 123.172 0.589 . . . . 0.0 110.548 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.95 -5.43 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 125.083 3.855 . . . . 0.0 115.9 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 21.7 tp -133.57 -23.49 1.84 Allowed 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 111.898 -178.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 48.2 m -68.74 -24.7 64.49 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.639 0.654 . . . . 0.0 109.878 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 69.3 ttt-85 -73.07 -27.78 61.93 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -78.27 -35.24 48.35 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.84 74.59 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.3 tp -65.76 -49.78 67.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.395 0.278 . . . . 0.0 110.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.26 -4.55 33.81 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 115' ' ' ALA . 19.1 tp -106.15 -4.59 20.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.09 0.556 . . . . 0.0 111.72 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 77.3 p -140.06 3.28 1.98 Allowed 'General case' 0 C--N 1.34 0.189 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.52 6.2 4.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.324 0.511 . . . . 0.0 112.147 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 1.4 mtm -127.38 -7.7 5.81 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.927 0.491 . . . . 0.0 111.887 176.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -150.65 -22.9 0.23 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.744 0.702 . . . . 0.0 112.103 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 79.05 28.05 54.87 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.218 -0.768 . . . . 0.0 113.426 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -51.25 149.22 4.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.275 1.037 . . . . 0.0 110.659 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.0 m -62.16 152.54 77.99 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.78 -17.02 37.73 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.996 2.464 . . . . 0.0 111.945 -176.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -78.98 -41.34 29.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.029 0.377 . . . . 0.0 110.368 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -78.7 -30.51 46.05 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.425 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -68.49 -25.36 64.93 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 175.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.05 -27.75 35.61 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.125 0.17 . . . . 0.0 110.757 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -70.45 -33.42 71.27 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.036 0.535 . . . . 0.0 111.628 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 77.7 mt -74.02 -4.29 34.46 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.411 HG13 HG22 ' A' ' 121' ' ' VAL . 28.6 pt -135.92 9.22 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 118.306 0.503 . . . . 0.0 110.978 177.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 50.08 61.04 3.39 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.136 1.374 . . . . 0.0 113.935 178.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 119' ' ' ILE . 22.3 m -134.69 -175.51 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 C-N-CA 123.854 0.862 . . . . 0.0 109.792 175.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -89.65 159.66 17.02 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -56.51 -39.11 72.75 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 122.565 0.346 . . . . 0.0 111.416 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.2 m -70.82 -20.57 62.55 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.868 0.467 . . . . 0.0 112.034 -177.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -73.98 -40.7 62.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.5 t -63.45 -38.22 81.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.12 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -60.56 -38.44 84.55 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.48 0.181 . . . . 0.0 110.856 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.3 m -76.12 -37.71 57.75 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.905 -0.134 . . . . 0.0 110.772 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.82 -34.09 77.04 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.415 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 m -81.34 -28.44 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 CA-C-N 118.452 0.569 . . . . 0.0 111.028 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 55.4 m -66.22 -40.52 90.36 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.49 -28.16 56.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.4 -44.11 65.56 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.344 -0.222 . . . . 0.0 111.246 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.61 -22.83 59.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 O-C-N 122.15 -0.344 . . . . 0.0 111.026 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.17 -42.63 72.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.611 0.187 . . . . 0.0 110.935 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -77.75 -17.8 57.17 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.151 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.5 mm -73.94 -53.93 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 173.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.43 -17.12 63.62 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -173.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -85.69 -10.84 55.06 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.478 ' HG3' ' H ' ' A' ' 142' ' ' ARG . 18.8 pt20 -156.69 -36.35 0.08 Allowed 'General case' 0 C--N 1.339 0.145 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -176.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 43.0 p 44.39 19.43 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.341 1.056 . . . . 0.0 112.852 -169.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.478 ' H ' ' HG3' ' A' ' 140' ' ' GLN . 34.6 mtp-105 -147.86 168.0 23.34 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.036 0.935 . . . . 0.0 110.357 -171.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -151.3 13.29 0.66 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.083 0.553 . . . . 0.0 110.684 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.8 -9.34 58.55 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.275 0.63 . . . . 0.0 112.427 -174.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -150.94 2.7 0.44 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.629 0.65 . . . . 0.0 112.65 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -155.8 165.27 37.0 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.835 0.454 . . . . 0.0 110.566 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 21.1 m -148.28 158.79 40.7 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 123.23 0.612 . . . . 0.0 109.76 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -51.17 177.51 0.04 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 1 C-N-CA 125.522 4.148 . . . . 0.0 113.432 169.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 17.8 ptm180 -143.47 178.84 7.49 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 123.056 0.542 . . . . 0.0 110.744 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -163.41 -174.45 33.29 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 82.8 p -145.83 11.14 1.23 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.625 0.37 . . . . 0.0 111.872 -177.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 56.0 p-80 -61.64 165.34 5.12 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 122.913 0.485 . . . . 0.0 110.885 178.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -152.84 179.12 8.94 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.577 0.351 . . . . 0.0 110.322 -177.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -138.37 16.98 2.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.373 0.669 . . . . 0.0 111.354 -176.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -145.26 172.63 12.86 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.162 0.585 . . . . 0.0 109.542 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 63.3 m80 -143.67 -178.8 6.08 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 122.99 0.516 . . . . 0.0 110.874 -173.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.027 -1.464 . . . . 0.0 110.009 -178.326 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.576 ' HG3' ' H ' ' B' ' 2' ' ' LEU . 14.7 ptm . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.285 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' LEU . . . . . 0.576 ' H ' ' HG3' ' B' ' 1' ' ' MET . 2.3 pt? -153.1 8.87 0.42 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.181 0.9 . . . . 0.0 112.555 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.429 ' C ' HD22 ' B' ' 4' ' ' LEU . 4.8 p-10 -151.06 168.92 23.13 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.935 0.494 . . . . 0.0 110.594 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.429 HD22 ' C ' ' B' ' 3' ' ' ASP . 3.5 mm? -129.33 156.24 78.75 Favored Pre-proline 0 CA--C 1.531 0.244 0 C-N-CA 124.038 0.935 . . . . 0.0 109.014 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.96 171.2 17.12 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 123.48 2.787 . . . . 0.0 110.957 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -166.59 3.69 0.05 OUTLIER Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.918 -0.379 . . . . 0.0 112.742 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -72.52 -2.51 19.98 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 117.691 0.746 . . . . 0.0 111.59 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -151.01 152.66 33.82 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.456 0.702 . . . . 0.0 109.216 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -151.88 20.43 0.69 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.644 0.377 . . . . 0.0 111.297 -176.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -59.86 146.68 41.15 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.971 0.509 . . . . 0.0 111.102 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -142.56 22.8 1.98 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.414 1.086 . . . . 0.0 110.462 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.21 9.84 0.76 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.891 1.276 . . . . 0.0 113.579 -177.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 32.4 t -158.27 150.18 21.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 176.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 46.6 m 47.57 16.47 0.07 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.013 1.325 . . . . 0.0 114.103 -177.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -144.68 24.3 1.54 Allowed 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.153 0.981 . . . . 0.0 110.147 -176.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -142.24 168.33 19.98 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 123.181 0.592 . . . . 0.0 110.824 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 49.5 m -146.99 54.61 2.07 Favored Pre-proline 0 CA--C 1.532 0.278 0 C-N-CA 123.288 0.635 . . . . 0.0 111.582 -176.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.85 171.47 14.49 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.427 2.751 . . . . 0.0 110.912 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -151.7 174.77 13.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.96 0.504 . . . . 0.0 110.555 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.83 11.92 1.26 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.133 0.573 . . . . 0.0 112.156 -178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 47.2 t -62.81 -18.8 21.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 123.213 0.605 . . . . 0.0 110.841 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -152.32 164.33 37.66 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.164 0.585 . . . . 0.0 109.837 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.2 m -150.52 175.8 11.55 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 123.46 0.704 . . . . 0.0 110.221 -178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -141.53 158.55 43.7 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 123.686 0.795 . . . . 0.0 109.452 178.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -152.65 11.75 0.51 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.543 0.337 . . . . 0.0 111.726 -177.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 149.58 10.66 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 122.775 0.43 . . . . 0.0 111.869 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -153.6 16.6 0.52 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.276 0.63 . . . . 0.0 111.013 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.61 -26.91 62.23 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.098 0.559 . . . . 0.0 112.269 -175.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.93 -42.52 96.84 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.32 -20.44 62.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 122.507 -0.408 . . . . 0.0 110.772 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.59 -36.53 70.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.74 -37.43 67.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -66.48 -32.63 74.11 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.563 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 57.8 m -66.6 -42.11 87.44 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.651 0.659 . . . . 0.0 110.74 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -24.5 64.95 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -107.73 -13.63 14.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -175.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -68.66 -31.26 70.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 170.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -57.5 -37.07 72.37 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 175.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.4 m -68.41 -12.58 61.36 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 46.6 mm -105.9 -16.02 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.803 -0.561 . . . . 0.0 111.259 -178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.92 28.62 0.17 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.252 0.621 . . . . 0.0 110.646 175.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -134.32 173.66 11.38 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.225 0.61 . . . . 0.0 111.309 -174.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -69.12 179.01 2.05 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.023 0.929 . . . . 0.0 110.89 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.4 m -136.82 155.01 76.73 Favored Pre-proline 0 C--O 1.233 0.234 0 C-N-CA 123.376 0.67 . . . . 0.0 110.41 -178.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -77.25 178.74 7.26 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.691 2.927 . . . . 0.0 110.531 176.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -145.99 -0.44 0.8 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.985 0.514 . . . . 0.0 110.929 175.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.15 -24.64 67.46 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 122.912 0.485 . . . . 0.0 112.242 -177.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 53.4 mtm -74.81 -32.78 62.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 122.225 -0.297 . . . . 0.0 110.788 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.71 -12.65 55.56 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.28 -20.44 61.51 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 69.9 mt -71.0 -18.35 62.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.181 -0.324 . . . . 0.0 110.337 172.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 18.5 mt -84.94 -19.15 32.63 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.728 173.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -73.14 8.19 1.76 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.932 0.333 . . . . 0.0 111.039 176.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -130.37 12.96 5.54 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.813 0.845 . . . . 0.0 109.986 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.1 mt -131.47 -26.36 2.06 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 123.568 0.747 . . . . 0.0 111.784 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.19 151.97 11.6 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.016 0.371 . . . . 0.0 110.511 171.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 39.1 tp -154.38 163.71 39.74 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.195 -0.316 . . . . 0.0 110.605 -176.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -63.41 169.23 3.87 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.101 0.56 . . . . 0.0 111.133 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 94.8 mt -142.49 172.52 12.58 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.951 0.9 . . . . 0.0 110.165 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 14.5 p -150.02 140.1 13.74 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.31 171.59 16.63 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 123.268 2.645 . . . . 0.0 111.165 178.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 . . . . . 0 N--CA 1.454 -0.245 0 C-N-CA 123.419 0.687 . . . . 0.0 110.117 -179.592 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.448 ' HG2' ' H ' ' A' ' 3' ' ' LEU . 55.8 ttm . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.8 p -141.41 20.31 2.22 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.475 0.71 . . . . 0.0 110.885 -178.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.448 ' H ' ' HG2' ' A' ' 1' ' ' MET . 49.2 tp -56.72 -33.36 66.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.669 0.788 . . . . 0.0 111.901 -178.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.61 -35.08 91.5 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 121.69 -0.631 . . . . 0.0 112.051 -176.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -74.33 3.17 7.77 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.747 0.819 . . . . 0.0 110.94 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.3 mm-40 -131.81 -1.93 3.74 Favored 'General case' 0 N--CA 1.458 -0.059 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 tt -111.37 -43.05 3.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.125 0.57 . . . . 0.0 110.624 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.42 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -54.57 -45.2 99.53 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -175.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 83.9 Cg_endo -75.04 2.26 6.85 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.264 1.976 . . . . 0.0 113.16 -176.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -130.85 9.92 5.0 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.777 0.431 . . . . 0.0 112.02 -177.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -56.6 -42.35 95.83 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.81 -7.53 14.48 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.922 1.748 . . . . 0.0 112.58 -173.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -71.61 -19.86 62.06 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.542 0.61 . . . . 0.0 111.945 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.402 HD12 ' N ' ' A' ' 14' ' ' LEU . 8.8 mp -77.18 -23.36 51.54 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.815 -0.553 . . . . 0.0 110.886 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -101.78 -15.56 16.9 Favored 'General case' 0 C--O 1.228 -0.027 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -52.48 -27.66 17.15 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.711 1.205 . . . . 0.0 110.884 175.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -137.42 -13.54 1.54 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.568 0.347 . . . . 0.0 111.241 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.44 -34.95 87.51 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 47.2 tpt85 -65.44 -20.88 66.55 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.1 0.95 . . . . 0.0 111.369 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.92 -3.6 55.76 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.824 0.45 . . . . 0.0 110.906 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mp -111.56 7.77 20.72 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.956 0.902 . . . . 0.0 111.141 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.1 p -140.46 -22.43 0.82 Allowed 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.43 8.73 60.04 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-O 119.558 -0.579 . . . . 0.0 112.673 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.5 t -154.51 138.12 16.04 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.331 1.065 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -72.5 -23.19 60.99 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.438 -0.164 . . . . 0.0 110.821 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -70.33 -39.06 74.96 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.314 -0.241 . . . . 0.0 110.562 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -82.2 -32.07 30.04 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.07 -43.55 90.27 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -72.5 -29.4 63.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 117.341 0.57 . . . . 0.0 110.817 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 tmmm? -70.7 -44.04 67.77 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.882 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -64.67 -31.9 73.33 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.129 0.422 . . . . 0.0 110.91 179.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.4 t -62.08 -52.75 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 117.995 0.361 . . . . 0.0 110.935 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -76.59 -26.77 55.38 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.358 -176.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.38 -24.98 61.34 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.284 0.234 . . . . 0.0 110.503 176.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 66.3 m -65.98 -40.15 90.96 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 175.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 -46.64 65.6 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -59.62 -25.32 64.56 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.902 0.481 . . . . 0.0 111.695 -178.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.88 1.0 32.69 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.132 0.573 . . . . 0.0 111.617 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.4 mt -123.8 -16.01 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 123.766 0.826 . . . . 0.0 110.561 -176.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.5 t -59.59 -13.92 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.181 0.592 . . . . 0.0 111.641 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 3.74 9.67 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.063 0.545 . . . . 0.0 111.298 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.31 55.73 1.23 Allowed Pre-proline 0 N--CA 1.452 -0.346 0 C-N-CA 122.935 0.494 . . . . 0.0 110.608 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.45 -8.84 20.21 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.109 2.54 . . . . 0.0 112.173 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -78.7 -6.66 56.38 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.903 0.481 . . . . 0.0 110.791 174.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -99.49 8.51 44.46 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.511 0.725 . . . . 0.0 110.774 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.415 ' N ' ' HD3' ' A' ' 47' ' ' PRO . 6.3 t80 -134.23 62.06 53.98 Favored Pre-proline 0 CA--C 1.533 0.317 0 C-N-CA 123.064 0.546 . . . . 0.0 109.976 -178.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.415 ' HD3' ' N ' ' A' ' 46' ' ' PHE . 54.4 Cg_exo -52.78 163.69 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.701 3.601 . . . . 0.0 114.849 -175.188 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.401 ' HD3' ' C ' ' A' ' 47' ' ' PRO . 0.5 OUTLIER -121.41 8.99 10.24 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.49 1.116 . . . . 0.0 109.506 177.287 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -76.08 5.25 6.98 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.168 0.987 . . . . 0.0 111.891 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.3 m -136.68 -179.2 2.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.991 0.916 . . . . 0.0 109.347 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.485 ' C ' ' H ' ' A' ' 53' ' ' ARG . 1.8 m-20 -54.46 147.03 30.69 Favored Pre-proline 0 N--CA 1.455 -0.219 0 O-C-N 122.388 -0.195 . . . . 0.0 110.546 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -71.44 18.54 0.27 Allowed 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 124.148 3.232 . . . . 0.0 110.528 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 51' ' ' ASP . 86.6 mtm180 -131.51 -30.38 1.68 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.001 0.92 . . . . 0.0 110.99 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 62.1 tp -72.01 -39.42 69.22 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.682 0.219 . . . . 0.0 110.588 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.68 -29.83 62.84 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.68 -40.9 97.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.63 0.372 . . . . 0.0 110.075 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.54 -27.67 41.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -68.56 -41.45 79.73 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.358 -0.214 . . . . 0.0 110.838 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 98.4 mmm -81.71 -31.24 32.2 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.796 -0.145 . . . . 0.0 110.888 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.4 -37.39 83.04 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -71.87 -24.26 61.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.54 -37.69 93.94 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.8 mm -73.78 -35.47 43.49 Favored 'Isoleucine or valine' 0 C--N 1.338 0.104 0 CA-C-N 117.892 0.846 . . . . 0.0 109.882 176.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -65.9 -37.41 86.03 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.92 -30.27 67.64 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.305 -0.247 . . . . 0.0 110.832 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.3 t -74.89 -28.83 60.79 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 110.618 -0.141 . . . . 0.0 110.618 178.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.54 -31.11 65.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.097 -0.377 . . . . 0.0 110.709 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -83.01 -12.55 57.16 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.539 0.336 . . . . 0.0 110.705 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.9 5.84 49.91 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.351 0.66 . . . . 0.0 111.124 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -137.53 0.48 2.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.005 0.522 . . . . 0.0 111.133 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.67 6.21 89.11 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.732 -0.482 . . . . 0.0 113.323 176.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -66.49 -20.0 65.93 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.985 0.892 . . . . 0.0 110.621 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.99 153.11 29.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.818 0.847 . . . . 0.0 109.688 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -147.61 -0.59 0.64 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.735 0.414 . . . . 0.0 111.958 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.5 t -160.61 175.47 12.64 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.155 0.434 . . . . 0.0 110.436 -177.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.4 p -153.0 159.82 42.95 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.489 0.715 . . . . 0.0 110.121 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -160.91 177.03 10.78 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.277 0.631 . . . . 0.0 109.482 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.0 m -141.64 155.43 45.71 Favored 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 123.296 0.638 . . . . 0.0 109.314 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -152.09 14.04 0.61 Allowed 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -173.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.56 165.97 2.66 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.057 0.456 . . . . 0.0 111.223 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.37 -10.88 55.46 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.52 21.23 0.03 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.949 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.7 t -137.11 6.44 2.85 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.715 1.257 . . . . 0.0 112.742 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -143.92 -36.01 0.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.02 -25.63 66.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.6 -24.56 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 122.567 0.347 . . . . 0.0 110.517 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.06 -1.4 56.79 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.859 0.463 . . . . 0.0 111.814 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -130.41 -16.07 3.53 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 117.804 0.275 . . . . 0.0 111.625 175.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.07 -1.54 32.89 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.771 0.259 . . . . 0.0 110.566 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -130.55 -8.54 4.11 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.585 0.754 . . . . 0.0 112.034 -177.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.8 mt -139.58 12.9 2.53 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -170.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.54 5.45 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -130.29 3.73 4.73 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 119.12 0.873 . . . . 0.0 112.642 -173.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 52.9 ttm -67.09 158.99 29.77 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 98.0 m -59.01 138.08 87.71 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 122.89 0.476 . . . . 0.0 109.944 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 75.5 Cg_exo -52.0 -7.87 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 125.19 3.927 . . . . 0.0 116.335 -178.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.1 tp -131.73 -22.29 2.4 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 119.002 0.819 . . . . 0.0 111.814 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.4 m -66.99 -19.18 65.67 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.929 -0.482 . . . . 0.0 110.059 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -65.87 -34.13 77.43 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.649 0.38 . . . . 0.0 110.25 175.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -80.7 -34.69 34.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.27 -32.38 74.01 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.966 -0.459 . . . . 0.0 109.794 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.71 -46.14 73.08 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.004 0.522 . . . . 0.0 110.78 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -74.94 -6.65 50.37 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.353 0.524 . . . . 0.0 111.445 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 74.9 mt -99.79 -6.29 27.19 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.767 0.427 . . . . 0.0 112.0 176.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -135.08 4.72 3.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.488 0.585 . . . . 0.0 112.551 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.96 7.93 1.86 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.49 0.316 . . . . 0.0 111.383 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.404 ' SD ' ' HB3' ' B' ' 32' ' ' LEU . 3.1 mtm -141.98 1.83 1.49 Allowed 'General case' 0 C--N 1.338 0.087 0 C-N-CA 123.487 0.715 . . . . 0.0 111.87 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -149.43 -17.93 0.28 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.628 0.649 . . . . 0.0 112.187 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 72.51 10.85 76.15 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 119.282 -0.732 . . . . 0.0 113.401 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -59.73 148.21 35.02 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.819 1.309 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.2 m -70.06 152.51 95.8 Favored Pre-proline 0 N--CA 1.452 -0.333 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.29 -24.08 25.75 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.208 2.605 . . . . 0.0 113.206 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.05 -34.6 66.39 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.611 0.364 . . . . 0.0 111.343 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -79.68 -38.28 33.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.87 -24.68 65.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.729 -0.177 . . . . 0.0 111.124 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.4 -39.11 65.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.958 0.345 . . . . 0.0 110.507 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -67.38 -26.11 66.3 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.597 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 18.4 tp -83.47 -6.2 59.39 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -176.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.411 HG13 HG22 ' A' ' 121' ' ' VAL . 15.7 pt -135.46 11.99 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.645 0.657 . . . . 0.0 111.435 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 56.81 53.71 7.95 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.186 0.994 . . . . 0.0 113.524 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 119' ' ' ILE . 28.2 m -136.38 178.61 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 123.443 0.697 . . . . 0.0 110.058 176.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -80.44 157.67 26.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 46.5 m -60.35 -34.4 73.79 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.9 -0.5 . . . . 0.0 110.818 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 84.0 p -72.28 -21.36 61.37 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 122.377 -0.202 . . . . 0.0 111.46 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -74.39 -36.36 63.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.2 t -64.05 -37.69 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.71 -33.23 73.65 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.2 m -77.31 -38.28 50.89 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 122.341 -0.224 . . . . 0.0 110.795 177.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.2 -35.61 80.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.128 0.422 . . . . 0.0 111.429 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.5 m -76.42 -27.65 17.54 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 118.805 0.73 . . . . 0.0 110.716 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.3 m -67.43 -35.76 79.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -81.15 -25.06 37.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.77 -47.34 66.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.51 -22.43 61.79 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.818 -0.135 . . . . 0.0 110.966 179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.51 -36.7 68.42 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -72.85 -25.11 60.99 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 117.668 0.213 . . . . 0.0 110.605 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 20.2 mm -72.83 -54.62 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -61.54 -21.68 64.48 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.614 0.366 . . . . 0.0 111.685 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -72.23 -24.58 61.41 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -177.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -154.46 -53.52 0.1 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -169.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 22.7 p 46.66 6.24 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -171.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.4 8.91 0.28 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 121.449 1.931 . . . . 0.0 114.441 178.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -142.39 174.26 10.78 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -174.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.417 ' H ' HD23 ' A' ' 144' ' ' LEU . 1.7 pt? -148.34 8.48 0.81 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.132 0.973 . . . . 0.0 110.869 177.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -140.55 21.06 2.37 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.3 1.04 . . . . 0.0 109.953 -179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 40.8 tp -57.32 155.66 8.7 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.169 0.588 . . . . 0.0 110.991 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 16.9 m -141.41 158.61 63.26 Favored Pre-proline 0 N--CA 1.456 -0.127 0 C-N-CA 123.746 0.818 . . . . 0.0 110.03 -176.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.3 -179.54 2.77 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 123.833 3.022 . . . . 0.0 110.755 176.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -137.82 15.72 2.88 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.451 0.701 . . . . 0.0 111.386 -177.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -170.68 -175.3 39.26 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 47.6 m -143.61 174.54 10.69 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.121 0.569 . . . . 0.0 110.208 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 33.6 t-80 -149.06 161.36 42.11 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 122.859 0.464 . . . . 0.0 110.25 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -147.96 175.11 11.25 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.461 0.704 . . . . 0.0 110.474 -176.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -136.3 7.08 3.09 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.156 0.582 . . . . 0.0 111.002 -179.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -156.21 152.74 28.18 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.578 0.751 . . . . 0.0 109.186 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 30.1 p80 -157.8 -5.11 0.09 Allowed 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 85.3 t60 . . . . . 0 C--O 1.251 1.171 0 CA-C-O 117.355 -1.307 . . . . 0.0 110.708 -178.179 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 110.652 -0.129 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.9 -3.82 24.66 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.914 0.485 . . . . 0.0 110.83 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -150.0 174.78 12.33 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.983 0.913 . . . . 0.0 109.816 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 96.7 mt -140.17 159.85 62.38 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 123.329 0.651 . . . . 0.0 110.191 -178.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -53.75 170.67 0.4 Allowed 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 124.834 3.689 . . . . 0.0 114.067 177.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -139.74 4.26 2.7 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.688 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -77.64 33.49 0.17 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.914 0.886 . . . . 0.0 110.717 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -134.77 -5.08 2.48 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.675 0.79 . . . . 0.0 111.547 -174.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -158.17 179.91 8.72 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.217 0.607 . . . . 0.0 109.527 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -141.55 12.04 2.11 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.172 0.589 . . . . 0.0 110.971 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -144.13 7.9 1.4 Allowed 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -174.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.36 9.01 1.4 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.534 0.606 . . . . 0.0 112.318 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 9.5 t -154.98 -168.76 2.98 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.89 0.476 . . . . 0.0 110.115 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 33.0 t -139.68 170.81 15.21 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.865 0.866 . . . . 0.0 109.857 -178.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -139.1 -8.94 1.32 Allowed 'General case' 0 CA--C 1.528 0.1 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm 44.37 43.47 6.12 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.66 0.784 . . . . 0.0 111.801 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 77.7 p -132.24 61.5 57.87 Favored Pre-proline 0 CA--C 1.533 0.297 0 C-N-CA 123.233 0.613 . . . . 0.0 111.738 -174.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.68 -175.71 0.99 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.931 3.087 . . . . 0.0 110.89 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . 56.84 21.55 6.17 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.079 0.951 . . . . 0.0 112.497 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' B' ' 20' ' ' LYS . 22.1 tptm -76.18 63.85 1.92 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.835 0.854 . . . . 0.0 111.313 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 34.5 m -59.87 178.85 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 123.994 0.917 . . . . 0.0 112.019 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -133.22 12.07 4.21 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.791 0.436 . . . . 0.0 111.644 -174.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.8 p -148.89 165.33 31.85 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 122.988 0.515 . . . . 0.0 110.459 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -147.98 -176.3 5.22 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.634 0.774 . . . . 0.0 110.236 -177.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 26.9 t70 55.3 25.36 7.39 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.217 1.007 . . . . 0.0 112.543 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -150.17 173.06 14.34 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.813 0.445 . . . . 0.0 110.838 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -144.86 20.01 1.63 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.214 0.606 . . . . 0.0 111.44 -176.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.6 tpt -55.03 -26.76 39.49 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.925 0.49 . . . . 0.0 112.166 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.25 -40.62 60.8 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.74 -20.3 62.65 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.565 -0.374 . . . . 0.0 110.514 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.4 -37.36 63.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.404 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 42.0 mt -77.5 -40.13 43.92 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.521 0.328 . . . . 0.0 110.302 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.46 -34.35 77.73 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.203 -0.311 . . . . 0.0 110.747 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 44.2 t -71.59 -37.36 70.99 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.092 0.405 . . . . 0.0 110.851 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.43 -23.87 65.58 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.247 0.219 . . . . 0.0 110.968 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -104.81 -11.75 16.63 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.146 -0.346 . . . . 0.0 111.289 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.0 -36.27 82.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -62.32 -35.76 80.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.654 0.381 . . . . 0.0 110.816 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 56.3 m -66.41 -11.82 53.72 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.548 0.574 . . . . 0.0 112.548 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 35.3 pt -129.4 13.16 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.926 -0.484 . . . . 0.0 111.545 -176.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.72 23.53 0.13 Allowed 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.599 0.76 . . . . 0.0 112.188 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.08 -178.53 5.75 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.753 -0.592 . . . . 0.0 111.826 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -63.74 -177.62 0.25 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.386 1.074 . . . . 0.0 112.503 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -134.3 156.62 78.81 Favored Pre-proline 0 CA--C 1.53 0.175 0 C-N-CA 123.466 0.707 . . . . 0.0 110.276 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.7 178.97 6.7 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 123.1 2.533 . . . . 0.0 110.622 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -146.47 -0.43 0.75 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.291 0.236 . . . . 0.0 111.456 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -63.01 -24.53 67.96 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.165 -0.334 . . . . 0.0 111.709 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.1 mtm -72.85 -29.8 63.49 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.217 0.207 . . . . 0.0 111.328 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.5 -14.37 43.28 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.1 -20.48 61.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.33 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.499 ' C ' ' H ' ' B' ' 54' ' ' LYS . 22.1 mt -76.69 -15.42 59.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 119.679 -0.201 . . . . 0.0 111.099 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -69.02 16.7 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.331 0.514 . . . . 0.0 111.13 173.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.499 ' H ' ' C ' ' B' ' 52' ' ' LEU . 53.7 mtmt -117.2 -3.77 11.47 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.456 1.102 . . . . 0.0 111.219 176.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -157.58 0.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -135.31 24.22 3.49 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.281 0.632 . . . . 0.0 111.529 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -139.91 134.08 31.1 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -150.0 167.83 25.6 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 123.451 0.7 . . . . 0.0 110.138 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.4 mt -141.0 15.12 2.27 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.48 0.712 . . . . 0.0 111.81 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 52.8 t -138.48 135.96 18.59 Favored Pre-proline 0 C--O 1.233 0.192 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.65 160.59 48.93 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 123.191 2.594 . . . . 0.0 111.523 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 41.0 ptt85 . . . . . 0 CA--C 1.528 0.097 0 C-N-CA 123.919 0.888 . . . . 0.0 110.238 -179.111 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.476 0.847 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.5 m 51.1 20.56 0.87 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.482 1.113 . . . . 0.0 113.54 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 42.3 tp -62.54 -27.27 69.05 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.111 -0.368 . . . . 0.0 110.687 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.46 -18.93 79.97 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-O 119.685 -0.508 . . . . 0.0 112.333 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -74.61 -2.31 25.44 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 117.984 0.892 . . . . 0.0 111.636 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -134.31 -21.37 1.82 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.18 0.592 . . . . 0.0 111.233 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.4 tp -75.59 -37.44 59.84 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.151 -0.343 . . . . 0.0 110.879 175.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.417 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -56.18 -46.75 99.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -173.067 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 87.7 Cg_endo -73.0 -3.47 13.69 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.523 2.149 . . . . 0.0 112.968 -177.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -129.22 11.11 5.89 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.311 0.505 . . . . 0.0 111.932 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.62 -46.26 99.85 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.21 -9.58 12.67 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 121.995 1.796 . . . . 0.0 112.427 -171.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.5 -32.52 73.45 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.505 0.593 . . . . 0.0 110.651 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.3 -18.22 61.81 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 122.368 -0.207 . . . . 0.0 111.047 -177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.6 mtm180 -98.88 -20.52 16.78 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.029 0.377 . . . . 0.0 110.773 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -61.42 -22.38 64.95 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 117.781 0.264 . . . . 0.0 110.74 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -130.34 -13.74 3.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.768 0.427 . . . . 0.0 110.876 175.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.19 73.82 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -68.17 -19.83 64.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 117.642 0.721 . . . . 0.0 111.052 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -100.93 4.3 42.47 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.623 0.769 . . . . 0.0 112.28 -175.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 59.9 mt -110.23 5.89 22.16 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.4 t -154.18 -20.43 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.964 0.802 . . . . 0.0 113.133 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.64 2.95 53.03 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 118.892 0.769 . . . . 0.0 114.225 174.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -154.82 146.31 23.11 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.658 1.229 . . . . 0.0 111.235 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -77.64 -17.92 57.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.926 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -70.92 -31.02 67.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -82.73 -32.57 27.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.798 0.439 . . . . 0.0 110.398 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.23 -39.94 81.99 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.33 -28.39 61.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.321 0.561 . . . . 0.0 110.4 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -69.26 -42.85 75.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.63 -42.14 95.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.217 -0.42 . . . . 0.0 111.656 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.7 m -67.64 -39.78 82.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.13 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -77.15 -29.26 54.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.515 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.03 -27.12 61.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.1 m -65.64 -40.48 92.56 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -40.92 26.26 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 121.082 -0.247 . . . . 0.0 111.068 -175.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -65.19 -24.65 67.43 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.221 -178.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.54 -1.16 23.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.267 0.627 . . . . 0.0 111.516 175.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 82.0 mt -118.14 -15.72 8.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.006 0.922 . . . . 0.0 109.763 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.18 -9.88 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.388 0.675 . . . . 0.0 111.333 175.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.2 -0.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.393 0.677 . . . . 0.0 110.898 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.21 57.51 1.49 Allowed Pre-proline 0 N--CA 1.452 -0.364 0 C-N-CA 123.29 0.636 . . . . 0.0 110.941 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -65.12 -11.0 27.85 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.086 2.524 . . . . 0.0 112.237 -177.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.17 -17.63 62.53 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.575 0.35 . . . . 0.0 110.653 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -83.3 0.8 44.13 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.999 0.52 . . . . 0.0 111.197 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -132.61 69.34 79.64 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.63 177.93 5.0 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 125.014 3.809 . . . . 0.0 112.197 -173.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 43.0 mmm-85 -123.56 7.09 8.89 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.727 0.811 . . . . 0.0 109.999 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -78.67 10.56 3.15 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.375 1.07 . . . . 0.0 111.844 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.47 171.85 16.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 C-N-CA 123.64 0.776 . . . . 0.0 109.843 -179.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.96 152.01 52.35 Favored Pre-proline 0 N--CA 1.453 -0.28 0 C-N-CA 122.605 0.362 . . . . 0.0 110.495 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -71.38 12.94 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.171 3.248 . . . . 0.0 111.749 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 28.5 mtp180 -131.6 -25.43 2.13 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.321 0.649 . . . . 0.0 110.856 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.3 tp -74.73 -35.94 62.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.38 -28.24 64.17 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.47 -46.01 88.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.14 0.576 . . . . 0.0 110.144 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -80.15 -27.01 39.12 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -65.31 -43.88 89.67 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 118.101 0.41 . . . . 0.0 111.179 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.9 mmm -74.4 -32.76 62.81 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.363 -178.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.6 -36.49 78.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.264 -0.273 . . . . 0.0 110.486 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.89 -26.17 66.75 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.782 0.433 . . . . 0.0 110.133 177.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.42 -39.89 69.18 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -74.19 -34.52 37.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.075 0 CA-C-N 117.794 0.797 . . . . 0.0 110.238 177.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -66.25 -33.02 74.8 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.438 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.41 -33.03 69.09 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 122.146 -0.347 . . . . 0.0 110.454 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -70.83 -25.92 63.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.5 -34.11 47.65 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.193 0.197 . . . . 0.0 110.717 177.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -71.94 -24.32 61.6 Favored 'General case' 0 C--N 1.34 0.178 0 O-C-N 122.14 -0.35 . . . . 0.0 110.336 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.22 0.58 18.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.194 0.598 . . . . 0.0 111.584 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -133.55 -1.03 3.16 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.092 0.557 . . . . 0.0 111.457 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.07 -4.72 83.16 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 122.145 -0.347 . . . . 0.0 112.957 177.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -74.07 -6.3 46.71 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -175.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.37 22.99 1.17 Allowed 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -78.83 4.2 14.67 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.123 -0.361 . . . . 0.0 111.214 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 8.9 t -152.46 168.11 26.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.774 0.83 . . . . 0.0 109.411 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.5 t -156.02 169.94 23.31 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 110.844 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -158.55 167.62 29.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.392 1.077 . . . . 0.0 108.821 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -69.55 170.07 11.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.276 0.56 . . . . 0.0 110.562 173.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -141.78 23.5 2.09 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.65 0.78 . . . . 0.0 108.967 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.73 -174.16 4.62 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.572 1.149 . . . . 0.0 109.577 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.73 11.57 5.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.068 0.547 . . . . 0.0 110.982 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.25 12.37 0.05 OUTLIER Glycine 0 CA--C 1.53 0.995 0 CA-C-O 119.193 -0.782 . . . . 0.0 113.122 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.2 p -138.4 -15.78 1.23 Allowed 'General case' 0 C--N 1.34 0.165 0 CA-C-N 118.373 1.087 . . . . 0.0 113.051 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -137.45 -30.84 0.83 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.12 -29.41 70.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 172.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.27 -35.65 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 122.521 0.329 . . . . 0.0 110.179 177.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.27 0.8 54.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.747 0.819 . . . . 0.0 112.319 -174.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.7 ppt_? -129.51 -18.84 3.49 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.201 0.455 . . . . 0.0 111.966 176.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.47 -14.54 61.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.047 0.385 . . . . 0.0 111.182 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -130.41 5.28 4.77 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.7 mt -138.68 18.8 2.69 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.172 0.589 . . . . 0.0 112.272 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.29 4.87 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -130.1 8.31 5.16 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.801 0.728 . . . . 0.0 111.845 -178.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 60.0 tpp -63.62 150.94 43.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.414 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 85.4 m -64.12 139.96 97.79 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 77.8 Cg_exo -52.73 -3.64 0.12 Allowed 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 124.739 3.626 . . . . 0.0 115.937 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -135.11 -24.98 1.4 Allowed 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.317 0.962 . . . . 0.0 112.285 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 90.4 p -69.38 -21.96 63.75 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.061 0.846 . . . . 0.0 109.432 174.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -68.09 -36.83 80.44 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -74.12 -36.14 64.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.34 73.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.736 -0.173 . . . . 0.0 110.81 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 46.8 tp -64.51 -46.91 80.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 6.2 mp -72.87 -11.35 60.56 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.239 -0.288 . . . . 0.0 111.178 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.0 tp -97.62 -7.37 31.22 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 p -140.59 0.67 1.66 Allowed 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.63 0.96 6.82 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.719 0.69 . . . . 0.0 111.575 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 5.7 ptp -156.29 21.84 0.36 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 177.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -146.27 -23.65 0.44 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.941 0.337 . . . . 0.0 111.798 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.03 8.55 83.21 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 118.797 -1.002 . . . . 0.0 114.728 170.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.21 145.95 49.4 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.336 1.568 . . . . 0.0 110.439 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 52.1 m -71.16 152.6 94.6 Favored Pre-proline 0 N--CA 1.455 -0.225 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.76 -27.16 32.94 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.621 2.881 . . . . 0.0 113.945 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -79.37 -39.07 33.47 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 118.061 0.392 . . . . 0.0 111.288 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -78.32 -31.22 48.68 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.27 -26.0 64.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.386 0.274 . . . . 0.0 111.063 176.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.56 -33.33 41.89 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 122.386 0.274 . . . . 0.0 110.595 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -70.29 -27.17 64.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.63 0.372 . . . . 0.0 110.764 177.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 19.7 tp -76.68 -8.44 57.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.427 HG13 HG22 ' A' ' 121' ' ' VAL . 23.0 pt -136.08 13.17 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.23 0.468 . . . . 0.0 111.609 178.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.93 55.93 7.21 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.427 HG22 HG13 ' A' ' 119' ' ' ILE . 22.4 m -136.32 179.89 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 C-N-CA 123.114 0.565 . . . . 0.0 110.313 175.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -82.63 159.76 22.61 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 176.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.5 m -57.53 -40.22 78.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 122.007 -0.433 . . . . 0.0 110.89 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -72.51 -20.81 61.29 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.655 0.382 . . . . 0.0 111.849 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -72.53 -36.7 68.36 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.635 -0.666 . . . . 0.0 109.97 176.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.24 -38.45 82.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.19 -32.86 73.55 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.56 0.164 . . . . 0.0 110.726 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.4 m -78.45 -39.37 38.79 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.43 -0.169 . . . . 0.0 110.751 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -65.34 -32.38 74.0 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 119.333 -0.365 . . . . 0.0 111.6 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.3 m -82.8 -29.17 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 CA-C-N 118.586 0.63 . . . . 0.0 110.912 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 50.9 m -67.42 -38.36 84.47 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -78.5 -27.17 46.08 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.347 -0.221 . . . . 0.0 110.658 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.37 67.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 117.833 0.288 . . . . 0.0 110.769 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.52 -22.37 57.16 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.193 -0.317 . . . . 0.0 111.232 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.66 -38.11 67.74 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.71 -26.24 61.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.351 -0.218 . . . . 0.0 110.489 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 15.3 mm -74.2 -51.18 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.14 -23.06 66.41 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -84.13 -10.74 57.54 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.478 ' C ' ' H ' ' A' ' 142' ' ' ARG . 16.5 pt20 -153.67 -54.44 0.11 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -177.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 18.9 p 46.86 -3.91 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.872 1.669 . . . . 0.0 114.982 -166.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.478 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.0 OUTLIER -78.01 166.13 23.2 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.306 0.957 . . . . 0.0 110.305 179.503 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -68.37 165.31 18.98 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.04 177.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.17 23.79 0.18 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.545 0.738 . . . . 0.0 110.709 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -135.37 21.26 3.4 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.881 0.873 . . . . 0.0 109.495 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.477 HD23 ' H ' ' A' ' 147' ' ' VAL . 0.6 OUTLIER -142.74 170.18 16.19 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.623 0.769 . . . . 0.0 109.817 -179.756 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.477 ' H ' HD23 ' A' ' 146' ' ' LEU . 4.1 t 44.55 52.23 9.53 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 124.24 1.016 . . . . 0.0 111.57 -176.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.32 -0.67 10.34 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.582 2.855 . . . . 0.0 112.382 -176.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -150.76 160.18 44.03 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.974 0.51 . . . . 0.0 109.99 -177.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -156.3 14.46 0.38 Allowed Glycine 0 CA--C 1.527 0.837 0 N-CA-C 111.536 -0.626 . . . . 0.0 111.536 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 37.8 m -65.98 177.73 1.28 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.039 0.935 . . . . 0.0 111.465 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -134.13 19.0 3.74 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.449 0.7 . . . . 0.0 110.631 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 58.8 m80 54.64 17.44 1.68 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.471 1.108 . . . . 0.0 112.794 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 51.6 p-80 -67.84 -4.52 12.95 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.522 0.729 . . . . 0.0 111.559 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -70.99 -2.36 15.08 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.887 0.875 . . . . 0.0 111.85 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -149.01 162.23 40.33 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.484 0.714 . . . . 0.0 109.635 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 67.9 m80 . . . . . 0 C--O 1.251 1.181 0 CA-C-O 117.313 -1.327 . . . . 0.0 110.511 -177.586 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 20.5 tp -146.89 9.08 0.99 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 122.397 0.279 . . . . 0.0 110.902 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -140.32 6.06 2.1 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.794 -0.566 . . . . 0.0 112.085 -176.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 73.9 mt -144.59 152.31 52.62 Favored Pre-proline 0 CA--C 1.53 0.211 0 C-N-CA 123.739 0.816 . . . . 0.0 109.687 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -75.68 -0.3 10.02 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.228 3.285 . . . . 0.0 113.335 -177.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.62 24.35 76.31 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 121.603 -0.686 . . . . 0.0 112.118 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -138.37 8.48 2.66 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.064 0.546 . . . . 0.0 110.995 -178.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -143.79 12.97 1.69 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.316 1.047 . . . . 0.0 110.421 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -65.78 -14.69 61.86 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.226 1.01 . . . . 0.0 113.329 -177.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 75.7 tttt 49.79 36.89 12.02 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.203 1.001 . . . . 0.0 112.777 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -132.45 27.35 4.41 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 124.32 1.048 . . . . 0.0 109.512 177.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -140.23 -174.96 4.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.093 0.957 . . . . 0.0 110.109 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 11.0 t -134.25 16.47 3.76 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.723 0.409 . . . . 0.0 110.909 -176.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 24.8 t -148.64 167.76 24.62 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.316 0.646 . . . . 0.0 109.598 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.57 171.56 19.24 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.058 0.543 . . . . 0.0 110.778 -177.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 38.2 mtmm -141.33 168.4 19.88 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 123.758 0.823 . . . . 0.0 109.829 178.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 49.8 m -148.86 161.04 34.05 Favored Pre-proline 0 CA--C 1.53 0.211 0 C-N-CA 122.935 0.494 . . . . 0.0 110.489 -178.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.27 174.38 0.24 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 124.698 3.599 . . . . 0.0 113.649 175.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.72 174.19 1.1 Allowed 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.851 0.86 . . . . 0.0 111.663 176.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' B' ' 20' ' ' LYS . 14.8 tptm -150.29 157.83 43.5 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.684 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 27.8 m -146.96 -172.89 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 123.879 0.871 . . . . 0.0 109.864 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.92 4.62 4.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.363 0.665 . . . . 0.0 111.562 -178.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 31.4 t -155.51 168.17 28.0 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.359 0.664 . . . . 0.0 109.396 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -143.94 167.13 23.06 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 123.502 0.721 . . . . 0.0 109.986 -177.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -67.97 -18.78 64.84 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.122 0.569 . . . . 0.0 112.0 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 51.5 tpt85 58.54 -41.72 0.06 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 127.891 2.477 . . . . 0.0 114.661 -176.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -164.12 -9.95 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.826 0.85 . . . . 0.0 111.479 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -62.26 -26.8 68.59 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 118.034 0.379 . . . . 0.0 111.656 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.57 -36.18 58.89 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.79 -24.47 58.66 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.968 0.384 . . . . 0.0 110.813 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.86 -45.48 70.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 84.2 mt -76.49 -36.46 57.82 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.598 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -65.5 -42.46 92.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -64.01 -42.05 97.26 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.355 0.525 . . . . 0.0 111.028 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.13 -29.39 70.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.561 0.219 . . . . 0.0 111.463 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -102.86 -12.49 17.51 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.125 -0.359 . . . . 0.0 111.331 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' GLN . . . . . 0.491 HE21 ' CG ' ' B' ' 41' ' ' GLU . 62.9 tp60 -69.16 -34.11 74.46 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 175.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -73.89 -24.71 59.75 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 121.068 -0.253 . . . . 0.0 110.937 176.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 26.6 m -73.14 -12.14 60.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 27.2 pt -123.25 18.02 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.097 0 O-C-N 121.814 -0.554 . . . . 0.0 112.464 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' GLU . . . . . 0.491 ' CG ' HE21 ' B' ' 37' ' ' GLN . 74.0 mm-40 -132.85 25.29 4.32 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -177.116 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.42 -15.77 0.84 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -166.41 158.8 14.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.179 0.9 . . . . 0.0 111.451 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.84 150.49 59.89 Favored Pre-proline 0 C--O 1.233 0.185 0 C-N-CA 124.318 1.047 . . . . 0.0 108.536 171.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' PRO . . . . . 0.404 ' C ' ' H ' ' B' ' 47' ' ' GLU . 72.1 Cg_endo -73.83 -35.78 4.14 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.016 2.478 . . . . 0.0 112.588 -177.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.2 t70 49.28 -10.49 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 127.481 2.312 . . . . 0.0 116.231 -177.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' B' ' 45' ' ' PRO . 15.7 pt-20 -69.4 -16.97 63.61 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.921 -1.112 . . . . 0.0 111.831 -177.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 42.0 mtm -74.09 -12.22 60.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.95 0.5 . . . . 0.0 111.297 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' B' ' 49' ' ' LEU . 87.9 mt -108.37 -17.28 14.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -68.19 -21.08 64.89 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.425 ' O ' ' HE2' ' B' ' 54' ' ' LYS . 4.2 pp -98.68 -6.82 28.92 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 122.881 0.472 . . . . 0.0 112.174 177.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.442 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.9 mt -89.9 -15.19 32.66 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.918 0.781 . . . . 0.0 109.906 166.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.59 22.68 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.532 1.133 . . . . 0.0 111.296 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.442 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.5 pttt -135.16 -4.11 2.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.78 0.832 . . . . 0.0 112.087 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -155.96 -5.83 0.12 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.39 2.46 0.64 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.958 0.799 . . . . 0.0 112.853 -176.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 4.2 mt -152.3 159.56 43.47 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.928 0.491 . . . . 0.0 110.58 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -148.86 162.56 39.6 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.242 1.017 . . . . 0.0 108.823 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 26.8 tp -151.88 -6.76 0.23 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 13.0 p -153.61 138.44 11.38 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 118.736 0.698 . . . . 0.0 109.833 -178.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.65 175.02 11.28 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.434 2.756 . . . . 0.0 110.997 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.208 0 C-N-CA 123.092 0.557 . . . . 0.0 111.033 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptm . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 m -142.35 21.77 2.04 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.054 0.542 . . . . 0.0 111.524 -174.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.1 tp -52.63 -30.81 33.51 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.485 0.714 . . . . 0.0 112.597 -177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.97 -20.79 78.06 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.427 -176.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -79.07 -1.0 33.68 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 117.42 0.61 . . . . 0.0 111.684 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -134.1 -13.88 2.4 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.452 0.301 . . . . 0.0 111.594 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 tp -80.23 -42.08 23.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.197 -0.314 . . . . 0.0 110.166 173.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.453 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.37 -45.47 99.86 Favored Pre-proline 0 CA--C 1.531 0.219 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -175.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 74.3 Cg_endo -70.64 -4.16 14.05 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.373 2.048 . . . . 0.0 112.177 -178.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.31 10.17 4.84 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.413 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 48.3 mt -57.26 -40.34 84.0 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.351 -0.833 . . . . 0.0 112.434 173.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 88.1 Cg_endo -77.87 -16.47 14.44 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 CA-C-N 120.842 1.337 . . . . 0.0 112.634 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -69.66 -24.98 63.69 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 118.435 0.561 . . . . 0.0 109.867 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.71 -21.65 65.3 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 175.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -92.46 -22.19 19.74 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.488 0.315 . . . . 0.0 110.386 178.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.3 ttp180 -52.69 -29.02 24.34 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 124.271 1.028 . . . . 0.0 110.773 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -138.27 -9.69 1.49 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 111.433 0.16 . . . . 0.0 111.433 177.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.96 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.89 -29.98 66.21 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.99 0.895 . . . . 0.0 110.264 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.23 -2.01 32.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.431 0.692 . . . . 0.0 111.358 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.3 mt -114.9 5.13 15.02 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.629 0.772 . . . . 0.0 111.501 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.8 p -141.6 -22.63 0.73 Allowed 'General case' 0 C--O 1.231 0.109 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.86 17.29 50.14 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.287 0.494 . . . . 0.0 112.08 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.2 t -153.45 131.97 12.16 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.62 0.71 . . . . 0.0 110.023 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.94 -20.77 64.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.872 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -70.94 -38.5 72.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.065 0.393 . . . . 0.0 110.578 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -82.19 -28.25 32.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.21 0.204 . . . . 0.0 110.745 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.6 -39.03 26.56 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.781 -0.927 . . . . 0.0 110.781 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -73.31 -30.37 63.33 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.283 0.542 . . . . 0.0 111.088 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -25.22 27.68 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 120.178 -0.609 . . . . 0.0 111.413 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -63.57 -37.91 89.13 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.076 0.853 . . . . 0.0 109.442 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.3 t -63.79 -46.65 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 117.704 0.229 . . . . 0.0 110.772 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -79.21 -32.59 44.05 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.534 -175.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.53 -25.99 63.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.13 -43.76 94.28 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.88 -41.28 62.42 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.573 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -62.46 -26.75 68.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.121 -0.362 . . . . 0.0 111.823 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.59 0.63 29.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.898 0.479 . . . . 0.0 111.363 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 72.6 mt -120.66 -13.47 8.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.227 1.011 . . . . 0.0 109.866 -177.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.6 t -58.83 -11.48 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 123.62 0.768 . . . . 0.0 111.921 175.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.75 3.0 9.52 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 123.47 0.708 . . . . 0.0 110.579 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.12 53.66 0.96 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 123.888 0.875 . . . . 0.0 110.978 -174.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.23 -10.12 27.97 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.933 2.422 . . . . 0.0 113.264 -175.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -78.96 -17.84 54.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.415 0.552 . . . . 0.0 110.654 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -78.56 -1.19 32.81 Favored 'General case' 0 C--N 1.335 -0.062 0 C-N-CA 125.025 1.33 . . . . 0.0 111.464 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -131.26 60.51 53.3 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 123.559 0.744 . . . . 0.0 109.995 -176.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.25 171.52 15.88 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 124.057 3.172 . . . . 0.0 111.409 -176.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -115.51 12.84 16.29 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.167 0.987 . . . . 0.0 109.658 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -72.27 10.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.71 1.204 . . . . 0.0 111.507 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.95 174.87 12.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 124.386 1.074 . . . . 0.0 109.504 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -55.4 148.05 34.78 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -68.34 10.62 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 123.865 3.043 . . . . 0.0 112.139 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -129.08 -25.06 2.8 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.012 0.525 . . . . 0.0 111.18 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.82 -32.98 68.13 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.522 0.601 . . . . 0.0 110.189 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.38 -34.14 57.91 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 177.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.39 -43.65 96.98 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.961 0.381 . . . . 0.0 109.992 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.14 -32.23 44.32 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -62.46 -41.12 98.53 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.179 -0.326 . . . . 0.0 110.959 -178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -80.93 -29.94 35.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.665 -177.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -66.86 -35.89 81.08 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -67.38 -27.68 67.3 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.114 0.566 . . . . 0.0 109.807 176.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.07 -39.86 92.96 Favored Glycine 0 CA--C 1.528 0.871 0 CA-C-O 119.796 -0.447 . . . . 0.0 112.055 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 48.6 mm -72.9 -37.97 55.55 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.071 0 CA-C-N 118.132 0.966 . . . . 0.0 110.264 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -31.79 70.1 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -31.4 61.56 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 121.309 -0.869 . . . . 0.0 110.503 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.8 t -75.52 -28.04 58.96 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.587 0.355 . . . . 0.0 110.988 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.92 70.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 122.158 -0.339 . . . . 0.0 110.124 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -72.57 -16.03 61.75 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.382 -0.199 . . . . 0.0 110.954 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.27 4.36 39.28 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.888 0.475 . . . . 0.0 110.968 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -133.29 -4.33 3.03 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.41 0.684 . . . . 0.0 111.128 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.39 -4.98 62.45 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.591 -0.561 . . . . 0.0 113.186 175.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -67.17 135.07 52.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.891 0.845 . . . . 0.0 110.31 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -165.69 173.57 10.63 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.451 0.701 . . . . 0.0 110.58 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -147.37 168.52 21.61 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 124.231 1.012 . . . . 0.0 109.085 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.4 t -64.9 -21.37 66.8 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.795 0.438 . . . . 0.0 111.363 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 92.1 p 44.72 24.16 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.767 1.627 . . . . 0.0 114.226 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -56.01 -60.41 3.52 Favored 'General case' 0 CA--C 1.527 0.065 0 C-N-CA 123.139 0.576 . . . . 0.0 111.572 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 81.0 p -178.79 177.53 0.86 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 123.558 0.743 . . . . 0.0 110.635 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -138.18 17.74 2.79 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.365 1.066 . . . . 0.0 108.797 175.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.62 -173.59 4.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.188 0.995 . . . . 0.0 110.219 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -139.81 10.8 2.44 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.787 0.435 . . . . 0.0 112.014 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -167.62 9.28 0.05 OUTLIER Glycine 0 CA--C 1.529 0.958 0 CA-C-O 119.359 -0.689 . . . . 0.0 113.721 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.5 t -147.4 7.52 0.88 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.471 1.135 . . . . 0.0 111.946 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -152.43 -33.07 0.13 Allowed 'General case' 0 CA--C 1.528 0.117 0 O-C-N 121.935 -0.478 . . . . 0.0 109.79 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.12 -23.71 63.07 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.9 p -66.84 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.138 0 C-N-CA 122.664 0.386 . . . . 0.0 110.03 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.7 -17.12 52.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 122.732 0.413 . . . . 0.0 111.137 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -88.1 -51.34 5.85 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.26 -1.67 4.86 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -171.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -130.22 6.22 4.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.015 0.526 . . . . 0.0 111.996 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 84.9 mt -144.5 19.27 1.7 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.791 0.836 . . . . 0.0 110.782 -178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.51 5.95 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -130.39 0.97 4.57 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.337 0.971 . . . . 0.0 112.255 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 ttm -68.17 152.15 45.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.2 m -59.25 137.88 88.5 Favored Pre-proline 0 CA--C 1.532 0.251 0 C-N-CA 123.178 0.591 . . . . 0.0 109.667 176.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.36 5.42 1.55 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.933 3.089 . . . . 0.0 114.01 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -130.95 -32.68 1.62 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.632 0.651 . . . . 0.0 110.298 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.6 m -62.64 -19.38 63.74 Favored 'General case' 0 CA--C 1.527 0.069 0 O-C-N 121.852 -0.53 . . . . 0.0 110.39 173.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.83 -33.84 76.78 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.071 0.548 . . . . 0.0 110.517 175.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -77.59 -30.37 52.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.53 -32.35 73.07 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.07 -0.394 . . . . 0.0 110.289 175.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 38.2 tp -66.32 -44.13 84.25 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.763 0.425 . . . . 0.0 110.438 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.87 -10.01 59.08 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.456 0.571 . . . . 0.0 111.677 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.8 mt -96.58 -4.71 40.73 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 67.7 p -137.19 6.05 2.8 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -177.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -139.54 10.55 2.49 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 177.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.5 mtm -140.07 -10.11 1.14 Allowed 'General case' 0 C--N 1.341 0.216 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -148.1 -8.25 0.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.225 0.92 . . . . 0.0 112.634 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 70.22 20.0 76.26 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.296 -0.724 . . . . 0.0 113.848 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -58.0 150.6 20.38 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.64 1.22 . . . . 0.0 109.884 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.2 p -70.24 160.79 79.61 Favored Pre-proline 0 C--O 1.233 0.207 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.82 -16.07 45.25 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 121.933 1.755 . . . . 0.0 110.521 176.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -79.28 -37.43 37.85 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 117.94 0.336 . . . . 0.0 110.823 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -76.95 -36.09 56.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 117.938 0.335 . . . . 0.0 110.129 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.0 -27.53 64.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.591 -0.243 . . . . 0.0 111.227 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.97 -36.44 64.58 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.727 0.298 . . . . 0.0 110.575 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -68.52 -31.11 70.13 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.861 0.465 . . . . 0.0 110.688 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.86 -7.45 57.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 8.6 pt -135.72 13.92 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.739 0.699 . . . . 0.0 111.992 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 56.8 53.61 8.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 29.1 m -137.16 179.13 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 122.936 0.494 . . . . 0.0 110.399 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.31 161.32 20.48 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.758 0.423 . . . . 0.0 110.178 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.7 m -60.74 -36.55 79.19 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.057 -0.402 . . . . 0.0 110.919 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -23.95 61.48 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.371 0.268 . . . . 0.0 110.946 -178.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.39 -36.55 68.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.789 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.7 t -64.81 -36.5 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -62.87 -34.57 77.66 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.651 0.263 . . . . 0.0 110.594 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.1 m -77.03 -37.52 54.74 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 177.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mp -66.46 -32.79 74.38 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.074 -0.489 . . . . 0.0 111.694 -178.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.62 -26.59 12.52 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.873 0.761 . . . . 0.0 110.811 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 99.0 m -68.89 -37.72 79.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -76.34 -27.62 56.56 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 122.273 -0.267 . . . . 0.0 110.319 176.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.4 -48.07 62.22 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.852 0.296 . . . . 0.0 110.471 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.87 -22.74 65.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 117.855 0.298 . . . . 0.0 111.129 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.44 -38.62 59.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 173.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -69.46 -30.11 67.94 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 119.757 -0.163 . . . . 0.0 110.571 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.9 mm -64.71 -49.41 80.35 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.69 -20.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -77.76 -20.88 52.61 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -176.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -151.69 -10.63 0.21 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.4 p -68.96 -19.03 64.16 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 119.951 1.25 . . . . 0.0 112.164 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.31 157.46 31.62 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 122.718 0.407 . . . . 0.0 111.093 177.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -150.26 4.88 0.54 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 5.3 mp -142.0 163.62 32.39 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.017 0.527 . . . . 0.0 109.85 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -142.45 1.7 1.39 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.599 0.759 . . . . 0.0 110.572 177.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.564 ' CD1' ' H ' ' A' ' 147' ' ' VAL . 0.1 OUTLIER -155.54 178.25 10.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.248 1.019 . . . . 0.0 108.477 -179.227 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.564 ' H ' ' CD1' ' A' ' 146' ' ' LEU . 52.5 t -141.2 125.3 10.31 Favored Pre-proline 0 N--CA 1.455 -0.218 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -75.69 172.83 15.56 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.699 2.933 . . . . 0.0 111.501 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -143.77 166.93 23.51 Favored 'General case' 0 C--O 1.23 0.073 0 C-N-CA 123.557 0.743 . . . . 0.0 110.014 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 176.89 -179.14 47.99 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 84.9 p -153.88 172.8 16.82 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 122.613 0.365 . . . . 0.0 110.751 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 69.3 m80 -146.33 172.62 13.21 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.738 0.815 . . . . 0.0 109.948 -178.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -146.48 9.56 1.07 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.577 0.351 . . . . 0.0 111.912 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 19.3 p80 -153.69 169.45 23.26 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.867 0.467 . . . . 0.0 110.641 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 52.9 p-80 -153.7 -1.52 0.21 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.077 0.551 . . . . 0.0 111.603 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 38.1 t-80 -157.45 166.15 33.76 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.114 0.566 . . . . 0.0 109.879 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 76.6 t60 . . . . . 0 C--O 1.252 1.226 0 CA-C-O 117.177 -1.392 . . . . 0.0 110.393 179.685 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 110.475 -0.194 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' LEU . . . . . 0.4 ' H ' HD23 ' B' ' 2' ' ' LEU . 1.7 pt? -148.81 5.03 0.67 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.964 0.505 . . . . 0.0 111.975 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -153.78 163.59 39.76 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 89.9 mt -144.81 160.67 46.26 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 123.853 0.861 . . . . 0.0 109.802 -177.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -52.01 162.36 1.94 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 124.148 3.232 . . . . 0.0 113.09 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.77 2.14 0.03 OUTLIER Glycine 0 CA--C 1.528 0.893 0 CA-C-O 119.719 -0.49 . . . . 0.0 112.758 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -152.54 150.93 30.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 117.921 0.861 . . . . 0.0 109.547 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -144.25 8.79 1.41 Allowed 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.441 0.697 . . . . 0.0 111.361 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -75.16 -5.84 46.47 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.735 0.414 . . . . 0.0 110.852 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -67.23 -3.36 7.62 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.627 0.771 . . . . 0.0 112.105 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -143.9 2.46 1.19 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.189 0.595 . . . . 0.0 112.026 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . 48.67 -169.2 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.048 0.939 . . . . 0.0 112.855 -175.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 49.7 m -139.29 5.88 2.3 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.028 0.531 . . . . 0.0 111.383 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 25.0 m 50.49 16.83 0.31 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.03 1.332 . . . . 0.0 114.141 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -142.55 0.9 1.32 Allowed 'General case' 0 C--N 1.34 0.183 0 C-N-CA 123.215 0.606 . . . . 0.0 111.646 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -157.7 156.52 31.85 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.246 0.618 . . . . 0.0 109.435 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 83.1 p -153.7 156.8 32.5 Favored Pre-proline 0 CA--C 1.53 0.182 0 C-N-CA 122.873 0.469 . . . . 0.0 109.86 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -78.09 4.94 5.75 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 124.239 3.293 . . . . 0.0 112.269 178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.31 148.44 32.18 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.785 0.434 . . . . 0.0 111.969 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -162.65 157.07 21.39 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 174.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 19.9 m -144.8 161.99 13.89 Favored 'Isoleucine or valine' 0 C--O 1.23 0.078 0 C-N-CA 123.111 0.565 . . . . 0.0 110.411 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -157.22 18.7 0.29 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.667 0.787 . . . . 0.0 110.929 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.0 p -51.25 148.28 4.86 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.439 0.696 . . . . 0.0 112.592 -175.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 ptpp? -156.1 14.84 0.33 Allowed 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.307 1.043 . . . . 0.0 110.515 -178.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -75.18 18.2 0.21 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 125.024 1.33 . . . . 0.0 112.419 -177.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.3 ptp180 -143.79 171.38 14.29 Favored 'General case' 0 N--CA 1.458 -0.059 0 C-N-CA 123.103 0.561 . . . . 0.0 111.826 -172.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -142.27 22.26 2.04 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 123.925 0.89 . . . . 0.0 111.067 -175.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.2 tpt -52.93 -26.97 16.71 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.634 0.773 . . . . 0.0 112.349 -177.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.22 -40.54 87.7 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.24 -22.7 60.36 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.549 -0.383 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.88 -37.83 67.18 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 81.7 mt -73.97 -37.41 64.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.98 -32.45 72.86 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 119.533 -0.27 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 62.3 m -66.62 -43.86 83.62 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.221 0.464 . . . . 0.0 110.705 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -26.97 65.12 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -103.7 -16.54 15.43 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 122.111 -0.368 . . . . 0.0 111.526 -176.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tp60 -64.45 -33.67 76.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 169.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -55.15 -38.66 68.54 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.157 0.583 . . . . 0.0 110.646 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 95.6 m -67.06 -12.61 60.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.835 0.454 . . . . 0.0 112.208 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 69.6 mt -105.54 -14.89 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.048 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -75.54 19.51 0.19 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.855 0.462 . . . . 0.0 111.53 176.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -136.48 169.05 18.31 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.054 0.454 . . . . 0.0 111.055 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -56.37 165.31 1.11 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.761 1.224 . . . . 0.0 113.129 -173.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.5 m -125.92 155.61 72.79 Favored Pre-proline 0 C--O 1.232 0.169 0 C-N-CA 124.022 0.929 . . . . 0.0 109.663 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.9 179.62 6.32 Favored 'Trans proline' 0 N--CA 1.448 -1.152 0 C-N-CA 122.938 2.425 . . . . 0.0 109.898 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -146.77 0.25 0.75 Allowed 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.589 0.356 . . . . 0.0 111.071 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -67.81 -18.13 64.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -175.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.9 mpp? -70.22 -29.15 65.9 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-N 118.204 0.456 . . . . 0.0 109.8 176.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.45 ' N ' HD22 ' B' ' 49' ' ' LEU . 2.4 mm? -93.31 -25.02 17.92 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.49 -20.88 66.53 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.4 pp -98.11 0.61 46.39 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.492 0.317 . . . . 0.0 111.626 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' B' ' 52' ' ' LEU . 23.8 mt -83.84 -21.83 31.92 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 166.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -66.12 17.28 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.1 0.96 . . . . 0.0 113.155 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.4 pttt -128.12 6.18 5.92 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.427 0.691 . . . . 0.0 111.236 177.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.2 -15.51 0.35 Allowed 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.107 0.563 . . . . 0.0 111.591 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.83 -2.46 23.73 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 117.935 0.334 . . . . 0.0 110.697 171.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 28.5 tp -151.81 169.85 21.22 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.54 1.136 . . . . 0.0 108.714 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 57.83 -176.26 0.07 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.411 1.084 . . . . 0.0 112.287 -176.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -120.8 9.07 10.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.497 0.719 . . . . 0.0 110.754 -177.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 14.0 p -150.86 138.96 12.55 Favored Pre-proline 0 CA--C 1.532 0.26 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -73.38 174.28 12.4 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.544 2.829 . . . . 0.0 111.287 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 51.3 tpt85 . . . . . 0 N--CA 1.458 -0.073 0 C-N-CA 123.416 0.687 . . . . 0.0 110.39 -179.597 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.5 tpp . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 119.819 -0.134 . . . . 0.0 110.803 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.3 t -152.18 153.38 33.72 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 122.712 0.405 . . . . 0.0 110.127 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.52 -26.68 66.45 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.335 0.654 . . . . 0.0 111.228 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.95 -23.14 78.41 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.744 -0.598 . . . . 0.0 112.046 -176.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -81.17 2.99 25.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.865 0.466 . . . . 0.0 111.004 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -131.51 -21.71 2.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.532 0.733 . . . . 0.0 111.089 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.3 tp -78.55 -38.79 39.54 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.298 -0.251 . . . . 0.0 110.926 176.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.413 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.8 -45.78 99.78 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -172.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 77.4 Cg_endo -72.86 -3.84 14.31 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.487 2.125 . . . . 0.0 113.285 -175.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.7 m80 -135.71 8.7 3.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.368 0.531 . . . . 0.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.8 tp -56.38 -44.03 99.55 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 124.14 0.976 . . . . 0.0 113.107 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.484 ' HG2' HD11 ' B' ' 40' ' ' ILE . 67.6 Cg_endo -81.8 -11.76 11.26 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.203 1.936 . . . . 0.0 113.373 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -64.9 -23.49 67.24 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 118.942 0.792 . . . . 0.0 111.255 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.75 -19.03 65.67 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 122.252 -0.28 . . . . 0.0 110.9 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm105 -103.03 -20.91 14.02 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.702 0.401 . . . . 0.0 111.042 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -62.84 -16.43 58.44 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.364 0.529 . . . . 0.0 111.805 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -140.32 -21.3 0.84 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.578 0.351 . . . . 0.0 111.449 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.66 -25.1 68.61 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 111.56 -0.616 . . . . 0.0 111.56 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -66.86 -12.12 58.11 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.386 0.593 . . . . 0.0 111.977 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -114.12 -6.45 13.07 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 122.962 0.505 . . . . 0.0 111.881 -174.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.5 mt -82.76 -0.36 47.34 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.04 0.382 . . . . 0.0 111.22 174.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 t -148.29 -4.13 0.47 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -175.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.16 17.04 78.54 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 121.553 -0.717 . . . . 0.0 113.034 174.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.3 t -156.1 126.23 6.56 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.143 0.971 . . . . 0.0 110.272 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -69.32 -19.04 63.88 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.715 -0.22 . . . . 0.0 110.78 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -74.29 -33.14 63.15 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -76.46 -35.11 58.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -71.36 -36.1 63.28 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -73.02 -34.67 66.5 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 117.565 0.682 . . . . 0.0 111.451 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.82 -22.93 49.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.431 178.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -67.32 -36.79 82.19 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 37.3 t -60.4 -47.01 94.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 CA-C-N 117.932 0.333 . . . . 0.0 110.58 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -77.38 -29.86 53.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.511 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.67 -27.39 61.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.604 -0.147 . . . . 0.0 110.604 176.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 59.4 m -66.93 -38.9 87.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.43 -44.1 53.34 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -176.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.3 -24.67 67.74 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 122.081 -0.387 . . . . 0.0 110.522 -178.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.38 0.16 23.48 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.378 0.671 . . . . 0.0 111.636 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.5 mt -122.7 -14.02 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 124.008 0.923 . . . . 0.0 109.879 -177.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.0 t -58.92 -15.54 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.142 0.577 . . . . 0.0 112.021 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.19 4.98 9.77 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.344 0.658 . . . . 0.0 110.884 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.18 53.88 0.91 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.144 0.578 . . . . 0.0 111.199 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -64.7 -10.83 26.26 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.291 2.66 . . . . 0.0 112.405 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.57 -15.34 61.29 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.494 0.318 . . . . 0.0 110.878 175.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -85.68 0.5 52.54 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.722 0.409 . . . . 0.0 111.664 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -129.17 63.99 69.3 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 122.799 0.44 . . . . 0.0 110.296 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.24 168.36 21.1 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 124.214 3.276 . . . . 0.0 111.918 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.53 12.17 10.73 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.054 0.942 . . . . 0.0 109.795 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -72.68 10.68 0.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.196 0.998 . . . . 0.0 111.52 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.4 m -135.86 174.69 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 C-N-CA 124.2 1.0 . . . . 0.0 109.216 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.31 146.23 32.92 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.104 0.161 . . . . 0.0 110.824 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.07 11.78 0.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 124.242 3.294 . . . . 0.0 112.37 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -128.75 -16.6 4.18 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.028 0.531 . . . . 0.0 110.428 174.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.63 -35.87 38.75 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 118.136 0.426 . . . . 0.0 109.888 -178.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.61 -32.63 45.68 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.2 -46.6 89.17 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.059 0.543 . . . . 0.0 110.214 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -74.05 -33.85 63.85 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.721 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.6 tpm_? -63.77 -43.15 97.23 Favored 'General case' 0 C--N 1.337 0.05 0 CA-C-N 118.728 0.695 . . . . 0.0 111.116 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 88.8 mmm -71.0 -34.38 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.576 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -68.82 -37.07 78.94 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.325 -0.234 . . . . 0.0 110.748 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -67.94 -20.17 65.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.509 0.323 . . . . 0.0 110.377 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.1 -40.41 50.81 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.4 mm -73.61 -34.34 41.47 Favored 'Isoleucine or valine' 0 C--N 1.338 0.089 0 CA-C-N 117.552 0.676 . . . . 0.0 109.852 176.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.0 t90 -65.54 -36.36 83.57 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.419 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.06 69.53 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.082 -0.386 . . . . 0.0 110.563 177.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.1 t -75.07 -28.93 60.53 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.317 0.247 . . . . 0.0 110.743 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.02 64.77 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.334 -0.229 . . . . 0.0 111.049 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -86.64 -12.84 47.32 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.465 0.306 . . . . 0.0 110.758 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.4 4.56 34.84 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.191 0.596 . . . . 0.0 111.131 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -137.7 0.82 2.27 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.107 0.563 . . . . 0.0 111.033 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.34 13.13 83.12 Favored Glycine 0 CA--C 1.528 0.885 0 CA-C-O 119.676 -0.514 . . . . 0.0 113.12 176.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -64.25 -18.38 64.5 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 117.949 0.875 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.42 155.15 31.61 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.119 0.968 . . . . 0.0 109.095 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -146.89 -10.68 0.45 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.8 t -164.52 174.52 10.82 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.767 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.7 p -155.82 167.3 30.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.736 0.814 . . . . 0.0 110.087 177.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -152.29 -50.34 0.11 Allowed 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 122.452 -0.155 . . . . 0.0 111.279 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -169.31 160.49 9.49 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.506 0.322 . . . . 0.0 110.985 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -160.24 23.73 0.16 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.082 0.953 . . . . 0.0 110.037 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.39 174.75 10.47 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.163 0.506 . . . . 0.0 111.227 -176.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -9.38 17.32 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.86 -11.79 0.14 Allowed Glycine 0 CA--C 1.527 0.828 0 CA-C-O 119.566 -0.575 . . . . 0.0 113.121 178.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.5 p -66.65 -3.54 6.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.295 1.047 . . . . 0.0 113.066 -176.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -129.19 -29.76 2.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.92 68.27 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -65.89 -29.86 48.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.444 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -0.06 53.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.395 0.678 . . . . 0.0 111.809 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -130.48 -16.59 3.43 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.865 0.302 . . . . 0.0 111.229 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.45 -1.42 15.67 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.855 0.462 . . . . 0.0 110.447 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -130.49 -12.87 3.88 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.352 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 73.8 mt -144.82 34.21 1.13 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.338 0.655 . . . . 0.0 111.247 -171.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.7 2.88 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -130.52 -5.92 4.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.532 1.06 . . . . 0.0 112.3 -177.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.8 ttm -67.35 146.05 54.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.325 0.511 . . . . 0.0 110.31 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 93.9 m -65.65 137.25 96.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.83 -20.75 39.05 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.578 2.185 . . . . 0.0 112.956 -174.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -78.61 -34.73 46.43 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.3 m -65.36 -23.41 66.98 Favored 'General case' 0 N--CA 1.457 -0.105 0 O-C-N 122.043 -0.411 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 62.6 mtm180 -67.88 -26.0 65.79 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.063 0.392 . . . . 0.0 110.556 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -77.72 -39.0 45.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.57 -33.25 74.65 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 122.082 -0.386 . . . . 0.0 110.202 177.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -54.43 46.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.974 0.509 . . . . 0.0 109.721 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.504 ' HA ' ' HE3' ' A' ' 107' ' ' MET . 4.4 pp -71.53 -15.44 62.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.1 mt -84.24 -9.3 58.63 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.882 0.31 . . . . 0.0 111.827 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.4 p -135.44 12.47 3.5 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -132.48 -0.65 3.57 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.504 ' HE3' ' HA ' ' A' ' 103' ' ' LEU . 33.3 mtm -145.9 -11.79 0.5 Allowed 'General case' 0 C--N 1.34 0.173 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -138.09 -2.91 1.82 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.23 0.923 . . . . 0.0 112.266 -175.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 55.58 26.47 45.81 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.167 -0.796 . . . . 0.0 114.315 173.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -56.68 151.62 13.63 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.493 1.146 . . . . 0.0 110.633 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.4 t -64.55 149.38 95.46 Favored Pre-proline 0 N--CA 1.453 -0.285 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 171.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -64.44 -16.54 55.67 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.938 1.759 . . . . 0.0 110.648 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -76.18 -39.85 53.81 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 117.767 0.258 . . . . 0.0 110.344 176.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -74.63 -35.26 62.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 122.119 -0.363 . . . . 0.0 110.312 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.04 -28.1 67.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.22 -0.3 . . . . 0.0 111.053 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.32 -27.69 42.1 Favored 'General case' 0 CA--C 1.526 0.05 0 C-N-CA 122.541 0.336 . . . . 0.0 110.403 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -75.13 -22.62 58.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.258 1.023 . . . . 0.0 111.037 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 69.8 mt -88.49 -7.88 55.8 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 7.5 pt -135.55 15.23 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.726 0.694 . . . . 0.0 111.351 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 46.13 62.17 2.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.952 1.701 . . . . 0.0 114.691 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 31.2 m -136.9 -179.78 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 C-N-CA 124.077 0.951 . . . . 0.0 109.392 174.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -81.41 159.93 24.19 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -60.6 -36.87 79.62 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 122.152 -0.342 . . . . 0.0 110.799 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.0 t -72.91 -24.64 60.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.134 0.174 . . . . 0.0 110.932 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.95 -34.14 68.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.085 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.9 t -65.72 -38.04 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.109 0 CA-C-N 118.211 0.46 . . . . 0.0 109.769 177.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.66 -35.78 77.07 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.7 m -76.29 -37.98 56.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.342 -0.224 . . . . 0.0 110.743 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mp -65.17 -36.19 83.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.666 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.44 -28.5 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-N 118.515 0.598 . . . . 0.0 110.974 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.7 m -68.67 -38.79 80.65 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -78.17 -26.17 47.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 122.356 -0.215 . . . . 0.0 110.638 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.21 -50.74 37.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.57 -22.51 65.38 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 117.73 0.241 . . . . 0.0 111.1 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.29 -34.77 76.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -81.59 -18.62 44.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.261 176.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 25.9 mm -68.91 -53.13 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 173.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.65 -16.83 62.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -64.91 -21.44 66.82 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.437 ' C ' ' H ' ' A' ' 142' ' ' ARG . 19.2 pt20 -155.57 -43.32 0.08 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -171.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 44.6 p 46.3 -1.97 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -169.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.437 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.1 OUTLIER -156.51 165.36 36.52 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.843 1.202 . . . . 0.0 110.413 174.36 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.08 23.51 1.19 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.076 0.551 . . . . 0.0 110.51 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.49 ' H ' HD23 ' A' ' 144' ' ' LEU . 1.5 pt? -138.59 176.84 8.35 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.616 0.766 . . . . 0.0 110.174 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 56.78 22.61 7.12 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.464 0.706 . . . . 0.0 110.767 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.56 -172.44 0.35 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.456 1.102 . . . . 0.0 111.504 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 28.9 m -128.26 153.63 78.87 Favored Pre-proline 0 CA--C 1.53 0.21 0 C-N-CA 123.549 0.74 . . . . 0.0 110.029 -177.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.24 176.01 9.16 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 124.434 3.422 . . . . 0.0 112.149 -178.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 45.43 -178.51 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 127.731 2.412 . . . . 0.0 115.208 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 175.02 23.8 0.03 OUTLIER Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.321 -0.711 . . . . 0.0 111.321 -177.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 70.0 p -59.35 164.66 3.16 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.486 0.715 . . . . 0.0 112.261 -177.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 28.9 p80 -148.84 16.23 0.97 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.718 0.807 . . . . 0.0 110.796 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 50.7 p-80 -143.95 -179.93 6.79 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.643 0.777 . . . . 0.0 110.4 -175.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -146.07 -179.5 6.76 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.079 0.552 . . . . 0.0 110.859 -177.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -146.43 168.29 21.52 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.234 0.614 . . . . 0.0 109.513 -179.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -146.16 14.67 1.31 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -175.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 35.7 m80 . . . . . 0 C--O 1.253 1.278 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.008 176.71 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 110.469 -0.197 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' LEU . . . . . 0.44 ' H ' HD23 ' B' ' 2' ' ' LEU . 1.7 pt? -144.89 4.29 1.11 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 122.596 0.358 . . . . 0.0 111.744 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -75.45 -2.81 30.51 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.862 0.465 . . . . 0.0 110.993 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.41 ' H ' HD23 ' B' ' 4' ' ' LEU . 1.8 pt? -151.91 156.65 34.3 Favored Pre-proline 0 N--CA 1.448 -0.543 0 C-N-CA 124.079 0.951 . . . . 0.0 109.049 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -73.96 -10.96 23.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.118 2.546 . . . . 0.0 112.64 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 124.99 -4.68 8.4 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-O 119.778 -0.456 . . . . 0.0 112.426 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -71.22 5.86 1.97 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 117.568 0.684 . . . . 0.0 112.827 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 77.0 tttt 51.45 28.78 4.72 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.996 0.918 . . . . 0.0 111.46 -177.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -149.99 173.25 14.03 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.533 0.733 . . . . 0.0 109.658 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -138.65 -173.68 3.62 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.09 0.956 . . . . 0.0 109.799 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 53.1 tttm 56.77 29.06 15.28 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.708 0.803 . . . . 0.0 111.073 -177.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.94 12.61 2.04 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.765 0.826 . . . . 0.0 110.66 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 32.2 t -153.0 173.82 14.93 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.876 0.87 . . . . 0.0 109.327 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 90.5 p -145.07 16.6 1.55 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.64 0.776 . . . . 0.0 110.724 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 57.09 18.48 4.09 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.608 1.163 . . . . 0.0 111.801 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -138.43 7.47 2.59 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.612 1.165 . . . . 0.0 110.376 177.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 65.6 p -150.78 53.38 1.19 Allowed Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.921 0.888 . . . . 0.0 110.41 178.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -70.37 177.31 6.14 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 123.738 2.959 . . . . 0.0 111.448 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.42 172.74 1.07 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.633 0.773 . . . . 0.0 112.143 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -147.5 156.97 43.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.403 177.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 27.4 m -144.52 -172.38 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.091 0 C-N-CA 123.972 0.909 . . . . 0.0 110.002 -176.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -57.21 163.01 2.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.293 0.637 . . . . 0.0 112.283 -178.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -143.88 26.96 1.51 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.779 0.832 . . . . 0.0 110.652 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -57.79 164.72 2.0 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 123.784 0.834 . . . . 0.0 111.805 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -143.2 23.31 1.85 Allowed 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.713 0.805 . . . . 0.0 111.205 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -67.88 16.91 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.77 1.228 . . . . 0.0 113.895 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -140.7 151.61 44.66 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.408 0.549 . . . . 0.0 110.476 -178.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -64.42 -25.65 68.11 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.968 0.507 . . . . 0.0 112.136 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.48 -34.69 60.14 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.63 -18.54 60.54 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 117.325 0.562 . . . . 0.0 110.865 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.63 -41.15 27.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 62.0 mt -71.02 -41.56 70.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.255 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -70.84 -25.9 63.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.928 -0.482 . . . . 0.0 111.314 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 45.5 t -64.74 -44.82 88.89 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.791 0.723 . . . . 0.0 109.769 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.4 -24.62 65.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -105.36 -1.51 25.02 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 122.088 -0.382 . . . . 0.0 111.62 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -79.79 -40.09 29.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -66.88 -16.88 64.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 175.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -88.01 -8.34 55.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.371 0.668 . . . . 0.0 112.496 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.484 HD11 ' HG2' ' A' ' 12' ' ' PRO . 7.2 tp -123.22 -7.95 7.88 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 CA-C-N 119.334 0.97 . . . . 0.0 112.909 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -80.6 33.62 0.31 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.173 0.589 . . . . 0.0 112.036 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -130.87 175.57 8.95 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.113 0.482 . . . . 0.0 111.918 -174.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -64.04 178.05 0.71 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.704 1.201 . . . . 0.0 112.747 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.59 156.04 74.96 Favored Pre-proline 0 CA--C 1.53 0.192 0 C-N-CA 122.918 0.487 . . . . 0.0 110.998 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -77.67 -178.86 4.92 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.577 2.851 . . . . 0.0 110.044 173.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -148.65 -1.9 0.5 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -66.51 -20.49 66.04 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.939 -0.476 . . . . 0.0 111.905 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 3.1 mpp? -67.93 -36.81 80.77 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' B' ' 49' ' ' LEU . 82.6 mt -83.43 -12.46 56.38 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.117 -0.364 . . . . 0.0 110.213 178.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -72.43 -20.57 61.39 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.937 -0.477 . . . . 0.0 109.882 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -73.63 -19.57 60.82 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 173.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.423 ' C ' ' H ' ' B' ' 54' ' ' LYS . 15.8 mt -78.93 -22.6 45.53 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.136 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -73.41 9.38 1.35 Allowed 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 172.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' B' ' 52' ' ' LEU . 36.9 ttpt -120.72 -0.55 10.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.064 1.346 . . . . 0.0 110.588 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.2 pp -149.65 -15.36 0.27 Allowed 'General case' 0 C--N 1.345 0.374 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -122.65 5.63 9.49 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.668 0.667 . . . . 0.0 112.399 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.58 ' HG ' ' H ' ' B' ' 58' ' ' GLU . 14.7 tp 56.01 -173.02 0.06 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.304 1.042 . . . . 0.0 111.604 179.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' GLU . . . . . 0.58 ' H ' ' HG ' ' B' ' 57' ' ' LEU . 44.1 mt-10 -128.47 9.7 6.09 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.782 0.833 . . . . 0.0 111.038 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 95.2 mt -146.45 168.4 21.27 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.756 1.222 . . . . 0.0 108.83 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 39.9 t -144.02 134.6 12.18 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.61 172.64 15.79 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.798 2.999 . . . . 0.0 111.423 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 51.4 tpt85 . . . . . 0 C--N 1.338 0.093 0 C-N-CA 123.434 0.694 . . . . 0.0 110.089 179.277 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 ttp . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m 47.33 28.68 1.1 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.679 1.191 . . . . 0.0 113.714 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.6 tp -63.42 -30.56 71.67 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 122.186 -0.321 . . . . 0.0 111.488 -177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -65.66 -35.42 91.06 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.3 mp0 -73.4 3.33 6.11 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.399 0.68 . . . . 0.0 111.115 177.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -128.42 0.58 5.65 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.283 0.633 . . . . 0.0 111.078 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.66 -39.54 2.74 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.952 0.501 . . . . 0.0 111.091 177.088 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.427 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.99 -44.78 99.62 Favored Pre-proline 0 CA--C 1.53 0.209 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -175.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 82.9 Cg_endo -75.71 3.48 5.93 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.173 1.916 . . . . 0.0 111.907 -179.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -130.28 9.42 5.19 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.9 mt -54.86 -44.24 99.29 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.58 -15.0 11.24 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 121.715 1.61 . . . . 0.0 112.708 -175.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -71.59 -25.33 62.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.462 0.573 . . . . 0.0 111.221 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.9 mt -69.53 -27.32 65.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 118.145 0.429 . . . . 0.0 110.009 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -88.76 -29.18 19.98 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.53 0.732 . . . . 0.0 110.544 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.5 ttp180 -53.83 -25.58 20.2 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.674 1.19 . . . . 0.0 112.759 -175.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -140.56 -20.98 0.83 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.25 -27.99 70.09 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -69.26 -33.01 72.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 117.557 0.679 . . . . 0.0 110.289 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.95 -11.44 59.9 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.0 mt -86.07 4.39 38.34 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.03 0.377 . . . . 0.0 111.213 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.8 t -149.31 -18.13 0.28 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.97 11.24 82.87 Favored Glycine 0 CA--C 1.526 0.719 0 CA-C-O 119.47 -0.628 . . . . 0.0 113.75 171.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -148.28 140.03 23.79 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.349 1.075 . . . . 0.0 110.864 -179.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -73.36 -19.22 61.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.365 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -73.72 -37.68 65.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 178.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -79.67 -32.59 41.49 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 176.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.4 -47.1 82.49 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.81 -33.02 74.73 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.594 0.697 . . . . 0.0 110.313 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.496 ' HE3' ' CE1' ' A' ' 31' ' ' TYR . 5.9 tmmm? -67.5 -46.78 71.93 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.63 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.496 ' CE1' ' HE3' ' A' ' 30' ' ' LYS . 22.7 m-85 -69.06 -36.07 77.24 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.392 0.542 . . . . 0.0 111.552 -178.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 t -60.81 -52.25 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -77.29 -27.83 53.14 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 122.423 -0.173 . . . . 0.0 111.375 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -24.24 63.23 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.721 -0.181 . . . . 0.0 110.847 175.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.0 m -67.82 -40.08 83.83 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.432 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.3 OUTLIER -73.59 -42.25 61.81 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.138 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -59.63 -25.49 64.71 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.995 -0.44 . . . . 0.0 111.858 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 0.49 31.33 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.797 0.439 . . . . 0.0 111.011 178.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 81.6 mt -120.9 -13.89 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -61.79 -10.64 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.87 0.868 . . . . 0.0 111.708 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.7 3.0 9.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.001 0.52 . . . . 0.0 111.296 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.1 55.36 0.97 Allowed Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.385 0.674 . . . . 0.0 110.304 -177.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.47 -10.63 28.45 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 123.318 2.679 . . . . 0.0 112.753 -173.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -81.52 -11.69 59.09 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 122.067 -0.395 . . . . 0.0 111.005 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -86.73 -14.61 41.92 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -65.31 114.9 17.26 Favored Pre-proline 0 CA--C 1.529 0.165 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -78.78 135.29 12.64 Favored 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 122.991 2.461 . . . . 0.0 112.193 -174.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -125.76 1.91 7.45 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 125.054 1.342 . . . . 0.0 109.976 175.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -79.42 9.56 4.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.086 0.954 . . . . 0.0 111.719 -178.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.3 m -137.93 -179.08 2.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 C-N-CA 123.846 0.858 . . . . 0.0 109.967 -176.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -52.65 152.96 6.07 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.301 0.641 . . . . 0.0 110.81 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.78 7.3 0.59 Allowed 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.383 3.389 . . . . 0.0 112.588 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -127.17 -25.02 3.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.221 0.608 . . . . 0.0 110.843 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 54' ' ' LEU . 28.7 mt -70.31 -33.9 72.08 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.039 0.381 . . . . 0.0 110.648 178.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.97 -41.0 93.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.62 -42.47 91.5 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.975 0.51 . . . . 0.0 109.977 177.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -77.47 -30.25 53.07 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -175.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -66.12 -41.99 89.76 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.71 0.687 . . . . 0.0 110.754 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.1 mmm -71.12 -34.76 71.37 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.502 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -71.0 -35.07 71.94 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 117.618 0.19 . . . . 0.0 110.752 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.25 -27.65 68.8 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.516 0.326 . . . . 0.0 110.204 177.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -72.71 -36.39 58.23 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -70.59 -38.24 72.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.101 0 CA-C-N 117.657 0.729 . . . . 0.0 110.142 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 76.0 t90 -69.29 -32.04 70.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 122.251 -0.281 . . . . 0.0 110.897 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.82 -32.94 68.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 122.099 -0.376 . . . . 0.0 110.179 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -74.11 -25.49 59.81 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.597 0.359 . . . . 0.0 110.484 178.006 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.38 65.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 122.392 -0.192 . . . . 0.0 110.626 179.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -69.79 -16.52 63.3 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.115 -0.366 . . . . 0.0 110.614 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.48 7.51 46.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.23 0.612 . . . . 0.0 111.208 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -134.24 -4.89 2.68 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 111.66 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 112.88 25.56 4.46 Favored Glycine 0 C--N 1.341 0.825 0 C-N-CA 120.911 -0.662 . . . . 0.0 114.372 173.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -128.64 171.53 12.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.558 1.179 . . . . 0.0 110.637 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 51.01 25.69 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.195 0.998 . . . . 0.0 112.576 -176.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -67.51 -7.19 23.85 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -152.42 -19.87 0.17 Allowed 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.292 0.496 . . . . 0.0 111.706 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.0 m 49.85 26.4 1.92 Allowed 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -56.54 153.12 10.63 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.767 0.427 . . . . 0.0 110.071 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.4 p -136.47 170.68 15.66 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.791 0.436 . . . . 0.0 110.922 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -152.92 23.3 0.57 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.946 0.498 . . . . 0.0 111.291 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.72 162.03 2.51 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.958 -0.464 . . . . 0.0 111.734 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.25 -13.55 62.33 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -173.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.62 20.39 0.06 OUTLIER Glycine 0 CA--C 1.527 0.791 0 CA-C-O 119.421 -0.655 . . . . 0.0 113.448 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 8.9 t -134.18 5.45 3.54 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.304 1.052 . . . . 0.0 112.322 -176.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -150.97 -30.1 0.19 Allowed 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.42 -22.79 65.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.6 p -71.53 -29.9 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.586 0.354 . . . . 0.0 110.328 176.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.71 7.7 28.94 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.774 0.83 . . . . 0.0 111.568 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -127.97 -40.37 1.7 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.389 0.676 . . . . 0.0 110.062 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.2 -1.77 8.76 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.525 0.33 . . . . 0.0 111.786 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 63.6 mtt180 -130.84 -3.0 4.1 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 123.022 0.529 . . . . 0.0 111.926 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.429 HD21 HD13 ' A' ' 137' ' ' ILE . 73.6 mt -136.35 14.59 3.24 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.362 0.528 . . . . 0.0 111.51 -172.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.79 18.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.424 1.09 . . . . 0.0 112.124 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 91' ' ' LEU . 85.2 mmt-85 -126.34 11.28 7.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.373 0.669 . . . . 0.0 112.064 -174.162 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 20.4 ptp -122.78 164.5 18.24 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 117.921 0.328 . . . . 0.0 110.304 175.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 63.5 m -62.45 143.29 96.09 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 123.258 0.623 . . . . 0.0 110.286 -176.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -53.06 -0.62 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 124.95 3.767 . . . . 0.0 115.139 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 31.1 tp -119.47 -19.44 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.406 0.548 . . . . 0.0 110.564 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.6 m -69.1 -27.72 65.85 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 mtp-105 -69.9 -26.79 64.33 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.525 0.33 . . . . 0.0 110.16 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -81.06 -39.34 25.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.13 -34.36 77.88 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.15 -49.26 68.03 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.557 0.343 . . . . 0.0 110.812 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.71 -4.65 35.8 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 115' ' ' ALA . 14.7 tp -106.64 -4.44 19.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.817 0.447 . . . . 0.0 111.772 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 72.8 p -140.11 5.02 2.08 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.9 -1.06 6.61 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.587 0.631 . . . . 0.0 112.541 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.433 ' HE2' ' HB2' ' B' ' 32' ' ' LEU . 8.3 ptp -150.71 12.27 0.69 Allowed 'General case' 0 C--N 1.338 0.091 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -143.75 -12.26 0.67 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.723 0.692 . . . . 0.0 111.995 176.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 67.2 15.07 64.92 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.994 -0.892 . . . . 0.0 114.135 173.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -60.93 146.68 45.91 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.844 1.322 . . . . 0.0 110.231 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.7 m -65.98 153.51 91.46 Favored Pre-proline 0 N--CA 1.454 -0.24 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.51 -17.26 43.56 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.555 2.17 . . . . 0.0 111.24 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -74.93 -34.39 62.1 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 117.847 0.294 . . . . 0.0 110.711 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -82.26 -34.54 28.73 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.423 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -67.0 -27.48 67.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.437 0.295 . . . . 0.0 110.698 175.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.71 -32.91 53.23 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.46 -23.53 62.71 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.397 0.679 . . . . 0.0 111.213 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -88.82 -5.32 58.12 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 16.9 pt -135.13 12.07 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 O-C-N 121.875 -0.515 . . . . 0.0 111.071 176.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 54.42 58.22 5.12 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.898 1.279 . . . . 0.0 113.566 176.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.47 -178.71 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.807 0.843 . . . . 0.0 109.816 176.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -83.96 160.79 20.98 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.3 m -58.67 -36.96 74.99 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 122.018 -0.427 . . . . 0.0 110.912 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 97.6 p -72.66 -20.93 61.16 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -76.27 -33.38 59.12 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 121.97 -0.456 . . . . 0.0 110.084 178.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.9 t -66.22 -37.56 79.98 Favored 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.69 -32.19 73.22 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.444 0.164 . . . . 0.0 110.858 177.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.4 m -76.1 -39.43 55.27 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.515 177.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.44 -33.78 76.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.224 -0.417 . . . . 0.0 111.456 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.2 m -78.5 -26.44 13.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.138 0 CA-C-N 118.765 0.711 . . . . 0.0 111.12 177.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 60.7 m -68.45 -40.08 81.22 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.1 -27.42 60.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.8 -48.68 36.0 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 122.473 -0.142 . . . . 0.0 110.653 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 117.909 0.322 . . . . 0.0 111.731 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.82 -41.0 62.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 174.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -72.35 -22.24 61.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 119.513 -0.279 . . . . 0.0 110.461 178.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.429 HD13 HD21 ' A' ' 91' ' ' LEU . 12.7 mm -75.29 -44.3 42.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.514 0.597 . . . . 0.0 109.745 176.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -69.51 -20.48 63.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -94.7 -8.02 38.99 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -172.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -155.29 -12.06 0.11 Allowed 'General case' 0 C--N 1.34 0.193 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -175.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 41.1 p -64.2 -14.24 54.08 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 119.941 1.246 . . . . 0.0 112.354 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.425 ' CD ' ' H ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -77.89 2.78 16.28 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 178.738 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -145.62 175.45 10.36 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.4 0.68 . . . . 0.0 110.065 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.43 13.29 0.65 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -177.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -140.19 167.62 21.7 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.053 0.454 . . . . 0.0 111.157 -178.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 37.6 tp -156.56 168.46 27.3 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.202 1.001 . . . . 0.0 108.682 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 30.6 m -139.35 153.77 71.21 Favored Pre-proline 0 CA--C 1.531 0.233 0 C-N-CA 123.034 0.534 . . . . 0.0 110.129 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.98 172.78 14.76 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 123.992 3.128 . . . . 0.0 111.461 178.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 40.0 ptt180 -152.75 -178.87 7.15 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.793 0.837 . . . . 0.0 110.156 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -163.48 175.81 39.68 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 89.5 p -152.77 15.79 0.57 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.944 0.497 . . . . 0.0 111.399 -177.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 66.1 t60 53.22 21.03 2.06 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.696 0.798 . . . . 0.0 111.913 -175.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 54.4 m80 52.22 20.41 1.34 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.656 1.182 . . . . 0.0 113.216 -178.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 47.7 t60 -150.01 10.52 0.71 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.708 0.403 . . . . 0.0 111.057 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 60.2 t60 52.65 21.38 1.84 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.48 1.112 . . . . 0.0 112.463 -177.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -70.68 -8.49 52.36 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.23 0.612 . . . . 0.0 111.768 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 77.0 t60 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 117.157 -1.402 . . . . 0.0 110.102 -179.399 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -152.37 20.36 0.64 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.862 0.465 . . . . 0.0 111.946 -177.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -132.31 11.27 4.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.62 159.6 59.78 Favored Pre-proline 0 CA--C 1.533 0.303 0 O-C-N 121.854 -0.529 . . . . 0.0 109.666 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.3 -22.86 12.4 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 124.083 3.189 . . . . 0.0 113.679 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 165.35 164.32 20.51 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 110.859 -0.896 . . . . 0.0 110.859 176.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -160.8 -28.91 0.06 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 122.813 0.445 . . . . 0.0 111.266 178.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -156.52 17.69 0.33 Allowed 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.971 0.508 . . . . 0.0 111.724 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -140.17 15.48 2.43 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.634 0.374 . . . . 0.0 111.245 -175.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -142.13 -8.67 0.9 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.838 0.455 . . . . 0.0 111.043 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 49.36 19.61 0.36 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.149 1.38 . . . . 0.0 113.266 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -157.22 155.63 31.18 Favored 'General case' 0 C--N 1.333 -0.137 0 O-C-N 122.066 -0.396 . . . . 0.0 111.02 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 80.2 p -160.12 0.26 0.07 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.846 0.458 . . . . 0.0 112.068 177.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 44.8 m -145.35 13.46 1.4 Allowed 'General case' 0 C--N 1.342 0.242 0 C-N-CA 122.756 0.422 . . . . 0.0 112.025 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -76.08 33.07 0.12 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.269 0.628 . . . . 0.0 112.254 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -140.63 163.91 31.59 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 123.688 0.795 . . . . 0.0 110.081 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 55.7 p -154.63 54.1 0.99 Allowed Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -177.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.61 169.87 17.7 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.778 2.319 . . . . 0.0 110.395 177.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -149.55 177.55 9.63 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.851 0.358 . . . . 0.0 111.557 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -154.4 21.53 0.48 Allowed 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.777 0.831 . . . . 0.0 111.606 -173.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 34.3 m -134.66 179.02 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 C-N-CA 123.308 0.643 . . . . 0.0 110.925 -174.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 25.8 pt20 -56.94 165.3 1.29 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.896 0.878 . . . . 0.0 112.757 -178.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 9.4 t -149.55 23.28 0.9 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.576 0.75 . . . . 0.0 110.469 -178.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -137.12 174.03 11.06 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 123.666 0.787 . . . . 0.0 110.001 -177.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.59 3.06 1.11 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -152.42 136.92 16.8 Favored 'General case' 0 C--N 1.339 0.128 0 O-C-N 122.19 -0.319 . . . . 0.0 110.376 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -160.54 4.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.148 0.579 . . . . 0.0 111.562 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.7 tpt -58.5 -26.6 63.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -70.43 -34.24 68.28 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.8 -22.16 43.41 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 117.285 0.543 . . . . 0.0 110.541 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.98 71.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.816 0.341 . . . . 0.0 110.099 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.433 ' HB2' ' HE2' ' A' ' 107' ' ' MET . 90.7 mt -74.78 -31.62 61.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.219 178.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -67.72 -37.66 82.53 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 117.94 0.336 . . . . 0.0 110.42 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -65.86 -37.23 85.64 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.833 0.288 . . . . 0.0 110.499 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.74 -29.12 68.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -102.23 -14.08 17.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 O-C-N 122.083 -0.386 . . . . 0.0 111.585 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -66.99 -36.76 82.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.78 -31.96 70.16 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.621 0.368 . . . . 0.0 110.791 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 96.1 m -73.68 -8.95 58.02 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.228 0.611 . . . . 0.0 112.327 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 16.7 tt -123.54 -7.18 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 118.77 0.714 . . . . 0.0 111.776 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.11 24.38 0.13 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.406 -0.809 . . . . 0.0 110.714 171.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -131.94 171.92 12.98 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.485 0.714 . . . . 0.0 111.179 -175.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -67.54 -177.34 0.73 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.399 1.079 . . . . 0.0 112.113 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 35.2 m -132.39 150.36 75.72 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.809 0.844 . . . . 0.0 109.231 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.29 -25.98 5.39 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.169 2.58 . . . . 0.0 113.051 -175.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 51.89 4.07 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.881 1.272 . . . . 0.0 114.015 -176.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -66.0 -22.12 66.44 Favored 'General case' 0 CA--C 1.528 0.108 0 O-C-N 121.461 -0.774 . . . . 0.0 111.243 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 27.6 mtm -70.71 -34.2 71.68 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.661 0.384 . . . . 0.0 111.017 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 71.7 mt -82.52 -15.03 53.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.888 -0.507 . . . . 0.0 109.884 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -70.31 -20.49 63.01 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.995 -0.441 . . . . 0.0 109.837 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.03 -14.7 61.47 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.192 -0.318 . . . . 0.0 110.655 173.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.427 ' C ' ' H ' ' B' ' 54' ' ' LYS . 31.1 mt -86.72 -20.93 26.97 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.093 173.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -69.84 16.23 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.705 0.402 . . . . 0.0 111.928 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.427 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -135.04 5.41 3.3 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.724 0.81 . . . . 0.0 111.175 177.446 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.425 ' C ' HD12 ' B' ' 55' ' ' LEU . 2.5 pp -151.52 -2.73 0.31 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 177.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -144.48 170.01 16.87 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.426 0.557 . . . . 0.0 110.101 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -153.95 140.4 18.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -178.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -147.75 160.83 42.3 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.414 0.686 . . . . 0.0 109.926 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 97.0 mt -146.47 175.58 10.45 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.646 0.778 . . . . 0.0 110.132 -175.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 14.6 p -149.66 140.33 14.02 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -70.53 167.05 26.55 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.014 2.476 . . . . 0.0 111.405 178.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 51.3 tpt85 . . . . . 0 N--CA 1.457 -0.1 0 C-N-CA 123.301 0.641 . . . . 0.0 110.403 -179.826 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.4 t -154.58 165.54 36.16 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.516 0.726 . . . . 0.0 109.409 178.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.6 tp -60.98 -35.75 77.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 121.974 0.11 . . . . 0.0 111.099 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.85 -29.16 67.63 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.168 -177.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -74.91 0.91 14.1 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.545 0.738 . . . . 0.0 110.251 176.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -137.12 8.37 2.95 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.419 1.088 . . . . 0.0 110.687 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.6 tp -118.31 -38.89 3.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.223 0.609 . . . . 0.0 110.622 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.433 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.77 -44.58 97.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.281 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.433 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 95.8 Cg_endo -74.09 -0.22 9.27 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.282 1.988 . . . . 0.0 112.631 -176.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.422 ' CE1' ' HE ' ' A' ' 53' ' ' ARG . 39.1 m-70 -133.67 3.17 3.52 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.017 0.527 . . . . 0.0 111.158 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.433 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 55.2 tp -59.64 -43.49 95.63 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 124.632 1.173 . . . . 0.0 113.786 -177.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.433 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 92.8 Cg_endo -75.0 -10.67 21.32 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.741 1.628 . . . . 0.0 112.367 -176.02 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-30 -66.57 -22.59 66.14 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.594 0.634 . . . . 0.0 111.365 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -74.05 -17.15 61.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.209 -0.307 . . . . 0.0 110.557 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.7 ttt85 -105.06 -26.25 12.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.763 0.425 . . . . 0.0 111.221 -175.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -61.68 -19.6 62.52 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 122.877 0.471 . . . . 0.0 111.647 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -136.83 -11.88 1.75 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.423 0.289 . . . . 0.0 111.143 175.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.27 -38.64 96.55 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 177.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.9 mtm105 -68.69 -24.9 64.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.105 0.953 . . . . 0.0 110.423 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.42 4.15 36.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.691 0.797 . . . . 0.0 111.253 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 tp -126.74 4.59 6.69 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.979 0.912 . . . . 0.0 110.297 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.3 p -135.81 -9.52 2.1 Favored 'General case' 0 C--N 1.338 0.078 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.76 2.36 44.41 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-O 119.494 -0.615 . . . . 0.0 114.093 173.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 t -157.03 140.08 15.38 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.262 1.031 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -66.54 -20.99 66.16 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.207 177.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -78.81 -32.03 46.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -79.01 -40.24 31.98 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.45 -32.31 83.72 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -71.88 -39.71 69.43 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 117.129 0.465 . . . . 0.0 111.264 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -26.43 30.77 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 120.458 -0.497 . . . . 0.0 112.122 -177.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -69.17 -35.43 76.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 119.097 0.862 . . . . 0.0 110.059 176.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.0 t -65.01 -43.71 96.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.147 0 CA-C-O 120.643 0.259 . . . . 0.0 110.526 176.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.3 ttp-105 -78.76 -28.48 44.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 122.302 -0.249 . . . . 0.0 111.661 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.57 -29.73 65.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 65.0 m -65.15 -37.88 88.82 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.4 OUTLIER -77.8 -42.72 32.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -177.037 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -63.41 -24.66 67.94 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.795 -0.565 . . . . 0.0 110.475 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.14 -0.08 26.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.406 0.682 . . . . 0.0 111.528 176.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 92.2 mt -120.24 -15.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.836 0.854 . . . . 0.0 109.696 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.02 -14.37 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.367 0.667 . . . . 0.0 110.775 173.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.85 4.41 9.43 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.679 0.792 . . . . 0.0 110.937 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.28 55.5 1.41 Allowed Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.33 0.652 . . . . 0.0 111.494 -177.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -68.43 -4.72 13.48 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.368 2.045 . . . . 0.0 110.868 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -85.81 4.11 38.53 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.2 1.0 . . . . 0.0 111.662 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -131.26 20.88 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.119 0.418 . . . . 0.0 111.358 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -131.83 53.67 12.09 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.457 0.703 . . . . 0.0 110.073 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.77 171.72 17.67 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.148 3.232 . . . . 0.0 112.752 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.416 ' C ' ' H ' ' A' ' 50' ' ' VAL . 5.1 mpt_? -113.08 18.82 17.72 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.179 1.392 . . . . 0.0 110.126 175.411 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.09 4.41 0.9 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.989 0.916 . . . . 0.0 110.809 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.416 ' H ' ' C ' ' A' ' 48' ' ' ARG . 30.4 m -135.73 177.75 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 125.462 1.505 . . . . 0.0 108.494 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -57.93 148.47 59.46 Favored Pre-proline 0 C--O 1.232 0.173 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.33 10.69 0.53 Allowed 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.793 2.995 . . . . 0.0 111.666 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HE ' ' CE1' ' A' ' 10' ' ' HIS . 98.9 mtt180 -126.52 -16.67 5.27 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 124.029 0.932 . . . . 0.0 110.613 177.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -45.3 64.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.47 -32.83 82.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.68 -50.08 74.38 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.227 -0.656 . . . . 0.0 109.227 178.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -76.71 -29.64 56.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.572 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -68.14 -42.03 80.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 119.671 -0.204 . . . . 0.0 111.145 -176.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.4 mmm -79.41 -31.31 42.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.994 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -68.02 -38.82 83.01 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.939 0.336 . . . . 0.0 110.212 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 tm0? -70.74 -25.2 62.82 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 122.506 0.322 . . . . 0.0 110.199 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.77 -39.75 85.66 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -72.34 -36.75 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.109 0 CA-C-N 118.194 0.997 . . . . 0.0 109.698 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -68.71 -35.61 77.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.522 -0.111 . . . . 0.0 110.916 -177.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.44 -31.12 66.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 176.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -72.48 -28.01 62.64 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.05 -36.7 58.93 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.384 -0.198 . . . . 0.0 110.549 177.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -73.51 -14.07 61.15 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.298 -0.251 . . . . 0.0 110.488 175.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.18 9.49 39.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.426 0.691 . . . . 0.0 110.458 176.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.3 -8.52 3.35 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.076 0.551 . . . . 0.0 111.056 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 149.91 -22.46 1.14 Allowed Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.311 -0.716 . . . . 0.0 114.708 173.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.07 140.01 58.78 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.424 1.112 . . . . 0.0 110.771 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -174.54 15.65 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.655 0.782 . . . . 0.0 111.516 178.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -84.28 170.91 13.19 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.11 0.481 . . . . 0.0 110.699 -176.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -64.13 152.7 39.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.005 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.7 p -164.33 9.25 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -175.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -63.51 -11.02 20.72 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -169.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.7 p -158.7 167.59 29.12 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.944 0.793 . . . . 0.0 112.05 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -149.31 19.11 0.95 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.135 0.974 . . . . 0.0 110.522 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.29 -171.57 3.87 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.481 0.712 . . . . 0.0 109.918 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -134.02 12.11 3.94 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.802 0.441 . . . . 0.0 111.604 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -163.9 9.56 0.08 OUTLIER Glycine 0 CA--C 1.53 0.97 0 CA-C-O 119.702 -0.499 . . . . 0.0 114.054 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 t -148.0 -0.25 0.61 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.106 0.953 . . . . 0.0 111.71 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -141.95 -36.16 0.43 Allowed 'General case' 0 C--O 1.228 -0.056 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.05 -28.79 69.11 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.06 -32.39 54.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.738 0.304 . . . . 0.0 110.561 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.23 0.09 55.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.42 0.688 . . . . 0.0 112.296 -175.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -132.26 -12.21 3.18 Favored 'General case' 0 C--O 1.227 -0.119 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.3 -3.42 36.61 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 173.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.507 ' C ' HD22 ' A' ' 91' ' ' LEU . 70.9 mtt85 -122.62 -12.49 8.11 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.75 0.82 . . . . 0.0 111.03 177.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.507 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.4 mm? -134.8 36.04 3.1 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.661 1.184 . . . . 0.0 110.085 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.412 ' C ' ' HD2' ' A' ' 93' ' ' ARG . . . -61.19 9.23 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.412 ' HD2' ' C ' ' A' ' 92' ' ' ALA . 2.8 mpt_? -130.42 0.42 4.52 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.922 0.783 . . . . 0.0 111.798 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.5 ttm -69.28 144.07 53.69 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.569 0.622 . . . . 0.0 109.797 177.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.441 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 24.2 m -67.19 137.47 94.19 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 123.052 0.541 . . . . 0.0 110.74 -178.223 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 50.6 Cg_exo -55.5 2.98 0.07 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 125.133 3.888 . . . . 0.0 115.448 176.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -128.63 -33.75 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.816 0.735 . . . . 0.0 109.937 -176.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 51.0 m -64.91 -25.42 67.88 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 121.922 -0.486 . . . . 0.0 110.115 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -70.46 -29.56 66.15 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 122.563 0.345 . . . . 0.0 110.413 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -72.71 -37.85 67.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.66 -31.56 68.52 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.082 -0.386 . . . . 0.0 110.173 176.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.49 -47.01 77.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.17 -11.16 60.43 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.712 -0.617 . . . . 0.0 111.544 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 65.2 mt -91.4 -5.1 54.95 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.103 -0.373 . . . . 0.0 111.627 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 68.5 p -135.55 6.32 3.23 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.58 7.91 1.94 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.059 0.544 . . . . 0.0 111.229 177.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.6 mtm -146.61 -2.1 0.67 Allowed 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -176.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -150.18 -17.59 0.25 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.919 0.781 . . . . 0.0 112.17 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 74.4 16.31 79.97 Favored Glycine 0 C--N 1.34 0.784 0 CA-C-O 119.345 -0.697 . . . . 0.0 114.005 173.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -61.27 149.88 36.49 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.639 1.22 . . . . 0.0 110.192 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.8 m -73.73 156.0 88.65 Favored Pre-proline 0 C--O 1.232 0.162 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -53.15 -27.18 36.14 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 123.198 2.598 . . . . 0.0 113.248 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.13 -33.89 70.52 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.938 -0.476 . . . . 0.0 110.798 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -83.53 -35.54 24.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.66 -29.6 67.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.148 0.179 . . . . 0.0 111.351 178.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.18 -32.93 50.32 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.574 0.226 . . . . 0.0 110.662 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -69.11 -30.87 69.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 52.5 mt -75.51 -6.5 50.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 10.1 pt -135.24 11.2 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 118.796 0.725 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 53.78 56.18 7.51 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.857 1.263 . . . . 0.0 113.955 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.4 m -135.98 176.08 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 C-N-CA 123.455 0.702 . . . . 0.0 110.183 175.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -73.31 156.77 38.09 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 120.859 0.362 . . . . 0.0 110.333 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 33.3 m -60.48 -35.9 77.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 121.95 -0.469 . . . . 0.0 110.978 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 89.5 p -75.54 -21.3 58.05 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.976 -0.453 . . . . 0.0 111.512 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -74.44 -43.13 57.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.365 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.7 p -67.25 -29.6 46.41 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.221 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.38 -33.86 76.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.1 m -75.94 -36.23 59.43 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.4 -35.1 79.48 Favored 'General case' 0 CA--C 1.527 0.094 0 O-C-N 122.195 -0.315 . . . . 0.0 111.546 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.7 m -79.15 -26.59 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 118.442 0.564 . . . . 0.0 111.02 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 51.9 m -67.13 -35.49 79.85 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -81.01 -25.06 37.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.478 -0.139 . . . . 0.0 110.873 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.83 -43.6 68.22 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 122.189 -0.319 . . . . 0.0 110.229 179.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -74.84 -22.23 58.81 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.177 0.191 . . . . 0.0 110.748 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.37 -34.84 73.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -75.73 -22.89 56.13 Favored 'General case' 0 N--CA 1.457 -0.116 0 O-C-N 122.289 -0.257 . . . . 0.0 110.54 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.0 mm -73.49 -52.52 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.148 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -69.83 -20.5 63.43 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -175.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -72.02 -20.69 61.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.464 ' C ' ' H ' ' A' ' 142' ' ' ARG . 22.4 pt20 -154.06 -37.82 0.1 Allowed 'General case' 0 N--CA 1.458 -0.067 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -173.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 56.4 p 47.26 -9.61 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.274 1.83 . . . . 0.0 115.796 -168.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.464 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.1 OUTLIER -165.98 -33.64 0.03 OUTLIER 'General case' 0 C--N 1.342 0.247 0 CA-C-N 119.914 1.234 . . . . 0.0 112.367 172.313 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ALA . . . . . 0.422 ' H ' ' HD3' ' A' ' 142' ' ' ARG . . . -171.48 171.87 5.31 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.393 0.677 . . . . 0.0 110.465 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.79 157.68 42.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.622 0.769 . . . . 0.0 109.36 175.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -154.71 10.21 0.35 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.039 0.136 . . . . 0.0 111.34 -176.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 58.2 tp -146.09 112.36 5.81 Favored 'General case' 0 N--CA 1.456 -0.138 0 O-C-N 121.717 -0.615 . . . . 0.0 110.542 -177.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 25.1 t -146.35 77.15 11.81 Favored Pre-proline 0 CA--C 1.53 0.208 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 178.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.42 6.1 1.03 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 124.673 3.582 . . . . 0.0 113.387 -172.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 94.7 mtm-85 -138.25 21.45 2.78 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.14 0.576 . . . . 0.0 111.328 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -161.17 20.31 0.21 Allowed Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.191 -0.783 . . . . 0.0 113.562 -177.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 73.7 m -140.61 10.99 2.27 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.357 1.079 . . . . 0.0 112.478 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 28.8 p80 -152.51 171.09 18.64 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.076 0.398 . . . . 0.0 110.733 178.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -144.07 5.41 1.31 Allowed 'General case' 0 C--O 1.232 0.156 0 C-N-CA 123.357 0.663 . . . . 0.0 111.067 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -156.22 164.55 38.22 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.313 0.645 . . . . 0.0 109.892 -178.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -154.61 172.04 18.5 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 122.877 0.471 . . . . 0.0 110.767 -178.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -146.61 7.08 0.96 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.959 0.504 . . . . 0.0 110.953 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 63.1 m80 . . . . . 0 C--O 1.253 1.242 0 CA-C-O 117.122 -1.418 . . . . 0.0 110.201 -178.042 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.477 0.88 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 20.3 tp -147.08 8.89 0.96 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.654 0.381 . . . . 0.0 110.829 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.1 t70 58.04 15.93 3.49 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.182 0.993 . . . . 0.0 112.791 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 7.3 mp -122.99 157.85 59.21 Favored Pre-proline 0 CA--C 1.529 0.161 0 C-N-CA 123.94 0.896 . . . . 0.0 109.056 177.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -73.11 -6.44 18.95 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 123.731 2.954 . . . . 0.0 112.178 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 174.62 173.79 40.81 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 178.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -154.39 -4.7 0.16 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 26.0 pttm 43.21 29.98 0.26 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.238 1.415 . . . . 0.0 113.846 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -150.4 168.0 25.43 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.03 0.532 . . . . 0.0 110.801 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -154.87 16.75 0.44 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 178.403 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -146.49 0.4 0.78 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -175.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.16 8.93 2.07 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.638 -0.664 . . . . 0.0 111.328 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 84.6 p -150.34 12.13 0.72 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.185 0.594 . . . . 0.0 111.056 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 28.9 t -148.81 170.53 18.02 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.534 0.733 . . . . 0.0 109.464 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -151.53 163.3 39.33 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.813 0.445 . . . . 0.0 110.116 -176.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -60.32 166.88 2.74 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.856 0.862 . . . . 0.0 110.372 177.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 31.2 t -137.21 145.13 48.66 Favored Pre-proline 0 N--CA 1.455 -0.183 0 C-N-CA 123.537 0.735 . . . . 0.0 109.621 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -74.16 5.12 3.76 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 124.039 3.159 . . . . 0.0 112.541 -179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . 57.78 -170.87 0.1 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.084 0.954 . . . . 0.0 112.377 -177.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 44.4 31.7 0.62 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.626 1.571 . . . . 0.0 113.465 -174.369 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 27.3 m -138.28 170.9 16.18 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.082 0 C-N-CA 123.961 0.904 . . . . 0.0 109.516 176.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 53.7 21.0 2.43 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.821 0.848 . . . . 0.0 112.205 -175.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 87.4 p -146.52 13.13 1.2 Allowed 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.648 0.779 . . . . 0.0 111.109 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.97 14.78 2.87 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 124.312 1.045 . . . . 0.0 110.756 -175.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -65.35 -11.06 38.41 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.056 0.542 . . . . 0.0 111.715 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 44.9 ttm105 -161.07 143.55 12.46 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.309 0.643 . . . . 0.0 110.009 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -150.27 17.91 0.84 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.615 0.766 . . . . 0.0 110.882 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.1 tpt -54.13 -35.06 61.79 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.18 -37.19 94.11 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.97 -15.6 58.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.36 -0.494 . . . . 0.0 111.254 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.3 -58.11 3.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.629 ' H ' HD23 ' B' ' 32' ' ' LEU . 1.9 pt? -81.51 -13.25 58.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.489 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -69.5 -35.6 75.69 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.582 0.628 . . . . 0.0 109.408 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 36.4 t -66.54 -35.41 80.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.7 -31.76 72.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 110.923 175.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -87.39 -20.86 26.09 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 121.759 -0.588 . . . . 0.0 111.059 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -69.51 -36.03 76.09 Favored 'General case' 0 CA--C 1.526 0.027 0 CA-C-N 118.447 0.567 . . . . 0.0 111.131 -178.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -67.03 -16.69 64.52 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 118.057 0.389 . . . . 0.0 111.115 178.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -79.16 -13.31 59.8 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 110.56 -0.163 . . . . 0.0 110.56 173.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.424 ' C ' ' H ' ' B' ' 42' ' ' GLU . 30.8 mm -102.46 -18.45 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 118.213 0.461 . . . . 0.0 111.052 -178.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -74.88 28.92 0.09 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.596 0.758 . . . . 0.0 110.663 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' B' ' 40' ' ' ILE . 80.6 mm-40 -137.67 177.62 7.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.084 0.954 . . . . 0.0 110.794 -174.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -65.82 179.33 0.88 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.889 0.876 . . . . 0.0 111.489 177.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.42 151.52 74.89 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.074 0.55 . . . . 0.0 110.173 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.07 79.15 3.47 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.091 3.194 . . . . 0.0 110.869 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.43 -3.77 0.49 Allowed 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -61.25 -23.77 65.89 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.766 -0.584 . . . . 0.0 112.179 179.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -69.26 -33.63 73.54 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 118.268 0.485 . . . . 0.0 110.211 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 78.7 mt -83.51 -13.03 55.51 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.89 -0.506 . . . . 0.0 110.561 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -71.12 -23.47 62.1 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.58 -17.89 61.13 Favored 'General case' 0 CA--C 1.523 -0.072 0 C-N-CA 122.741 0.417 . . . . 0.0 110.804 174.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.439 ' C ' ' H ' ' B' ' 54' ' ' LYS . 37.2 mt -90.59 -14.76 31.85 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.317 -0.24 . . . . 0.0 110.889 173.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -72.35 18.54 0.09 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.062 0.945 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.6 pttt -137.14 6.11 2.82 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.472 1.109 . . . . 0.0 110.978 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -149.31 -18.5 0.28 Allowed 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.25 -8.65 56.73 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.314 0.506 . . . . 0.0 112.02 178.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 1.4 mm? 54.01 176.38 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.309 1.444 . . . . 0.0 113.447 -176.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -158.4 175.45 13.7 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.529 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.444 ' H ' HD23 ' B' ' 59' ' ' LEU . 2.0 pt? -148.08 163.81 35.77 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.734 0.813 . . . . 0.0 110.424 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.8 p -155.24 142.75 13.95 Favored Pre-proline 0 CA--C 1.533 0.309 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -178.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.21 177.47 7.19 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 123.285 2.656 . . . . 0.0 110.902 175.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 . . . . . 0 CA--C 1.533 0.305 0 C-N-CA 124.72 1.208 . . . . 0.0 111.665 -179.02 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.3 mtp . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p -144.98 12.2 1.41 Allowed 'General case' 0 C--N 1.339 0.115 0 C-N-CA 122.689 0.396 . . . . 0.0 111.587 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.0 tp -54.92 -33.68 62.41 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.909 0.484 . . . . 0.0 111.755 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.49 -23.92 65.31 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.79 -0.569 . . . . 0.0 112.007 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -81.0 -0.4 39.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.427 0.613 . . . . 0.0 111.177 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -134.37 3.56 3.36 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.403 0.681 . . . . 0.0 110.432 -178.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 7' ' ' LEU . 0.8 OUTLIER -106.06 -41.65 5.31 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.873 0.869 . . . . 0.0 108.952 178.05 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.434 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -60.84 -43.5 91.85 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.219 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 74.3 Cg_endo -72.69 -4.46 15.38 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.386 2.057 . . . . 0.0 113.284 -173.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -135.56 12.77 3.47 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.236 0.471 . . . . 0.0 110.801 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -56.03 -41.05 89.02 Favored Pre-proline 0 CA--C 1.537 0.474 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -179.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.49 -8.28 12.62 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 121.954 1.77 . . . . 0.0 112.466 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.92 -21.42 65.99 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.855 0.752 . . . . 0.0 110.834 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 63.4 mt -73.09 -18.98 61.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.795 0.27 . . . . 0.0 110.487 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.9 mtt-85 -97.93 -19.75 17.88 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -53.6 -27.24 25.59 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.88 1.272 . . . . 0.0 111.833 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.8 p90 -140.44 -14.86 0.97 Allowed 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.681 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.5 -29.73 75.93 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -70.77 -3.68 20.01 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.23 1.015 . . . . 0.0 112.037 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.32 6.36 7.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.631 0.772 . . . . 0.0 110.398 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.4 tp -107.96 6.63 27.37 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.293 1.037 . . . . 0.0 110.103 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.8 p -132.87 -19.28 2.31 Favored 'General case' 0 C--O 1.23 0.047 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.28 -2.84 87.39 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-O 119.672 -0.515 . . . . 0.0 112.712 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.6 t -157.92 139.26 13.54 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.214 1.007 . . . . 0.0 110.858 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -65.23 -20.1 66.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.42 -0.175 . . . . 0.0 111.184 178.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -72.99 -34.56 66.49 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 178.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -83.18 -29.02 28.91 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.226 -0.286 . . . . 0.0 110.226 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.52 -40.98 67.05 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.67 -33.67 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 117.434 0.617 . . . . 0.0 110.684 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -69.72 -45.92 67.11 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 119.469 -0.301 . . . . 0.0 111.448 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -67.65 -32.58 73.36 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.453 0.57 . . . . 0.0 111.248 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.6 t -63.94 -50.15 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 CA-C-N 118.173 0.442 . . . . 0.0 110.673 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -75.74 -27.38 58.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.974 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.8 -23.03 59.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.741 -0.171 . . . . 0.0 110.828 176.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.0 m -63.57 -48.0 79.21 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.446 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.2 OUTLIER -70.58 -35.26 72.95 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.73 0.3 . . . . 0.0 110.333 -178.157 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -67.12 -16.66 64.46 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.876 -0.515 . . . . 0.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -87.39 -6.88 58.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.956 -0.465 . . . . 0.0 111.281 174.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 36.2 mm -98.36 -27.59 3.68 Favored 'Isoleucine or valine' 0 C--N 1.339 0.122 0 CA-C-N 117.856 0.298 . . . . 0.0 110.682 -179.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.0 m -66.69 -7.09 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -89.81 -15.83 31.48 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 118.077 0.399 . . . . 0.0 110.559 175.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -170.04 89.67 0.53 Allowed Pre-proline 0 CA--C 1.532 0.273 0 C-N-CA 124.199 1.0 . . . . 0.0 109.2 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.48 -5.97 15.35 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.029 2.486 . . . . 0.0 112.219 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.6 -14.51 59.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.497 0.319 . . . . 0.0 110.623 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -83.87 9.35 12.29 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.273 0.629 . . . . 0.0 111.352 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -130.54 79.97 71.13 Favored Pre-proline 0 N--CA 1.451 -0.412 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.43 157.59 61.17 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.303 2.669 . . . . 0.0 111.408 -173.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 7.46 2.77 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.256 1.022 . . . . 0.0 110.493 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.7 9.49 1.8 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.623 1.169 . . . . 0.0 110.835 174.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.2 m -131.77 -172.43 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 C-N-CA 124.509 1.123 . . . . 0.0 109.272 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -58.43 148.98 62.55 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.26 13.19 0.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 124.169 3.246 . . . . 0.0 112.372 -177.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -129.11 -16.95 3.95 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 119.312 -0.375 . . . . 0.0 111.371 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' A' ' 54' ' ' LEU . 18.4 mt -71.56 -39.03 70.91 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.649 0.659 . . . . 0.0 110.479 179.458 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.2 -39.02 94.34 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -54.3 47.77 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.541 0.736 . . . . 0.0 110.147 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -72.3 -36.29 68.89 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.81 -175.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 52.9 tpt85 -60.77 -41.84 96.31 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.617 0.644 . . . . 0.0 111.394 -174.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.8 mmm -81.38 -26.8 35.19 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.521 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -68.17 -38.0 81.59 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.686 0.676 . . . . 0.0 110.323 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -67.75 -24.79 65.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.47 0.308 . . . . 0.0 110.242 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.22 -37.89 71.81 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -72.25 -40.04 64.97 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 CA-C-N 117.985 0.892 . . . . 0.0 109.999 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -69.14 -35.58 76.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 122.555 -0.091 . . . . 0.0 110.825 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.86 -27.69 65.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 122.387 -0.196 . . . . 0.0 110.689 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.1 t -82.72 -18.14 41.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.286 0.234 . . . . 0.0 110.703 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -46.75 30.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.327 0.251 . . . . 0.0 110.823 -179.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -77.41 -15.89 59.11 Favored 'General case' 0 CA--C 1.527 0.09 0 O-C-N 122.276 -0.265 . . . . 0.0 111.211 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.71 2.03 24.26 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.412 0.685 . . . . 0.0 111.237 176.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -137.75 0.9 2.27 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.089 0.556 . . . . 0.0 111.362 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 87.41 5.94 78.48 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 119.728 -0.484 . . . . 0.0 113.327 175.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.65 -15.41 63.51 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.155 0.978 . . . . 0.0 111.405 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -160.11 153.77 22.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.726 0.81 . . . . 0.0 109.75 177.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -146.33 -9.4 0.5 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.699 0.4 . . . . 0.0 112.046 177.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -165.84 176.85 7.58 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.397 0.679 . . . . 0.0 109.681 -178.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.4 p -152.65 155.91 38.22 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.772 0.429 . . . . 0.0 110.464 177.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -157.26 162.28 39.2 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.8 m -139.0 165.54 26.86 Favored 'General case' 0 C--O 1.23 0.055 0 O-C-N 122.084 -0.385 . . . . 0.0 110.79 -177.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -149.34 25.92 0.87 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.879 0.472 . . . . 0.0 110.994 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.07 164.88 1.47 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.983 0.42 . . . . 0.0 111.307 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.97 -10.65 30.95 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -174.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 157.04 21.74 0.03 OUTLIER Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.255 -0.747 . . . . 0.0 113.437 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.5 t -137.51 6.73 2.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.423 1.111 . . . . 0.0 112.955 -175.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -143.03 -35.89 0.39 Allowed 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.709 0.403 . . . . 0.0 110.043 173.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.44 -27.06 67.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.8 p -66.56 -27.62 40.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 C-N-CA 122.536 0.334 . . . . 0.0 110.422 178.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.66 -0.45 55.17 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.013 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -130.29 -18.52 3.24 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 118.149 0.431 . . . . 0.0 112.087 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.1 -1.82 31.09 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.766 0.426 . . . . 0.0 110.543 174.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.595 ' C ' HD12 ' A' ' 91' ' ' LEU . 99.4 mtt180 -130.24 -13.49 3.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.004 0.522 . . . . 0.0 112.317 -177.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.595 HD12 ' C ' ' A' ' 90' ' ' ARG . 9.9 mp -129.68 15.51 5.92 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.481 0.713 . . . . 0.0 111.611 -172.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.33 9.51 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 177.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 91' ' ' LEU . 66.9 mtt85 -124.6 15.34 8.8 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.545 0.738 . . . . 0.0 110.892 -176.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 39.3 ttm -115.35 142.38 46.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.028 0.931 . . . . 0.0 109.467 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.504 HG23 ' H ' ' A' ' 98' ' ' SER . 5.7 t -68.04 140.42 93.49 Favored Pre-proline 0 CA--C 1.531 0.22 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -53.2 -22.73 20.63 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.968 3.112 . . . . 0.0 114.418 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -79.3 -46.27 18.04 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.031 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.504 ' H ' HG23 ' A' ' 95' ' ' THR . 55.6 m -67.81 -23.54 65.2 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.214 -0.304 . . . . 0.0 111.175 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.0 ttp180 -67.73 -33.32 74.63 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.22 -37.49 61.09 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 177.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.85 76.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 178.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.1 tp -61.78 -50.92 70.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.577 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 3.8 pp -79.44 0.88 27.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 115' ' ' ALA . 14.8 tp -97.29 -6.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.231 -0.293 . . . . 0.0 111.391 177.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.8 p -140.53 -16.78 0.9 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -81.53 -12.89 58.66 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.465 1.03 . . . . 0.0 113.045 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.577 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 1.8 pmm? -154.08 14.9 0.47 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -129.58 -11.99 4.42 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.525 0.602 . . . . 0.0 112.052 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 68.51 7.55 53.57 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-O 118.887 -0.951 . . . . 0.0 114.761 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -58.39 150.34 22.52 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.354 1.577 . . . . 0.0 110.634 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.9 p -71.8 161.28 79.54 Favored Pre-proline 0 N--CA 1.454 -0.269 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.48 -16.49 47.5 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.059 1.84 . . . . 0.0 111.02 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -79.17 -45.05 20.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 117.884 0.311 . . . . 0.0 110.572 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -74.07 -32.0 63.08 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.413 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -69.54 -22.67 63.54 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.239 0.216 . . . . 0.0 110.991 177.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.11 -29.79 34.75 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.516 0.198 . . . . 0.0 110.694 179.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.3 -38.94 82.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.663 0.385 . . . . 0.0 111.333 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 57.0 mt -72.91 -4.06 29.61 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 12.5 pt -135.41 11.64 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 118.986 0.812 . . . . 0.0 111.281 177.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 52.03 59.57 4.44 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.905 1.282 . . . . 0.0 113.827 176.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.03 -178.42 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 123.521 0.728 . . . . 0.0 109.932 176.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -83.28 160.26 21.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 86.2 m -60.49 -37.56 81.49 Favored 'General case' 0 C--O 1.232 0.177 0 O-C-N 121.954 -0.466 . . . . 0.0 110.579 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.9 t -70.5 -24.51 62.86 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 122.364 -0.21 . . . . 0.0 111.029 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -71.68 -37.53 70.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.126 178.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.05 -38.63 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-N 118.401 0.546 . . . . 0.0 109.842 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -58.78 -37.86 77.26 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 110.508 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.7 m -78.05 -38.4 44.54 Favored 'General case' 0 N--CA 1.457 -0.085 0 O-C-N 122.432 -0.167 . . . . 0.0 110.656 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 60.3 mt -64.85 -33.35 75.79 Favored 'General case' 0 N--CA 1.456 -0.139 0 O-C-N 122.082 -0.386 . . . . 0.0 111.672 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.3 m -80.56 -28.68 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 CA-C-N 118.587 0.631 . . . . 0.0 110.521 177.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 89.5 m -68.58 -38.2 80.5 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -76.72 -27.62 55.51 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.267 -0.271 . . . . 0.0 110.888 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.67 -49.85 55.74 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 122.23 -0.294 . . . . 0.0 110.309 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.02 -22.34 62.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.716 -0.183 . . . . 0.0 111.131 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.91 -37.18 64.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.746 0.248 . . . . 0.0 110.726 177.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -74.45 -19.35 60.42 Favored 'General case' 0 N--CA 1.457 -0.079 0 CA-C-N 117.599 0.182 . . . . 0.0 110.544 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 19.2 mm -75.11 -56.39 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.79 -16.64 64.21 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -70.71 -22.29 62.46 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 179.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -157.57 -38.15 0.07 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -173.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 30.3 p 44.89 19.05 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.504 1.121 . . . . 0.0 112.274 -169.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -147.51 148.25 31.0 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.351 1.06 . . . . 0.0 109.636 -171.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -163.29 40.72 0.1 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.277 0.631 . . . . 0.0 110.038 179.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.2 22.47 7.85 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.893 0.877 . . . . 0.0 111.462 -172.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.69 156.97 46.97 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 122.967 0.507 . . . . 0.0 110.386 178.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.401 ' N ' HD23 ' A' ' 146' ' ' LEU . 2.2 pt? -160.31 169.67 22.67 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.575 0.35 . . . . 0.0 111.081 -177.255 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 10.7 t 41.52 59.26 9.15 Favored Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 124.728 1.211 . . . . 0.0 112.014 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.52 166.04 28.65 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.383 2.722 . . . . 0.0 110.616 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -153.93 157.59 39.43 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 170.48 -174.79 44.47 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 79.8 p -149.29 21.19 0.95 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.135 0.574 . . . . 0.0 110.642 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 49.8 p-80 -139.7 11.03 2.47 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.414 0.686 . . . . 0.0 111.717 -174.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.28 12.23 1.96 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.915 0.486 . . . . 0.0 112.102 -179.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 55.8 t60 45.18 40.64 5.1 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.593 1.157 . . . . 0.0 113.115 175.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 29.8 p-80 -55.72 163.4 1.39 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.766 0.427 . . . . 0.0 111.822 177.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -153.05 165.57 35.17 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 123.221 0.609 . . . . 0.0 109.518 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 28.8 p80 . . . . . 0 C--O 1.252 1.222 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.622 -179.332 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 110.27 -0.27 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 72.9 mt 52.76 22.98 2.51 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.148 0.979 . . . . 0.0 112.811 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -70.86 4.52 2.51 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.848 0.859 . . . . 0.0 111.969 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.467 HD13 ' H ' ' B' ' 4' ' ' LEU . 0.0 OUTLIER -145.23 156.23 54.23 Favored Pre-proline 0 CA--C 1.533 0.292 0 C-N-CA 123.615 0.766 . . . . 0.0 109.888 -176.756 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.52 153.1 49.5 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.324 2.683 . . . . 0.0 111.254 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 169.29 14.89 0.02 OUTLIER Glycine 0 CA--C 1.524 0.623 0 CA-C-O 119.625 -0.541 . . . . 0.0 112.969 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -148.6 176.07 10.65 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.102 0.951 . . . . 0.0 111.85 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -67.09 9.45 0.2 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.558 1.143 . . . . 0.0 113.715 -176.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -130.99 0.8 4.25 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.53 0.605 . . . . 0.0 111.633 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -140.98 3.77 1.83 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.196 0.599 . . . . 0.0 111.317 176.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -141.67 6.87 1.87 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.871 0.869 . . . . 0.0 110.363 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.0 -177.42 6.52 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.252 1.021 . . . . 0.0 109.275 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 50.5 m -133.87 -0.71 3.09 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 25.3 t -162.05 162.87 28.95 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.994 0.426 . . . . 0.0 110.488 177.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -152.93 7.17 0.4 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.374 1.07 . . . . 0.0 110.556 176.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -71.02 169.63 14.54 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.808 0.843 . . . . 0.0 111.295 -176.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 56.4 p -154.92 52.1 0.69 Allowed Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 123.183 0.593 . . . . 0.0 111.403 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -70.11 -0.17 6.8 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 123.551 2.834 . . . . 0.0 112.633 -177.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . 53.73 -166.93 0.07 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.144 0.978 . . . . 0.0 112.468 -178.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -145.88 147.16 31.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 2.2 t -144.15 5.41 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -169.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.11 17.11 2.27 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 -173.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 27.5 m -64.88 -0.24 1.44 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.908 0.483 . . . . 0.0 112.21 176.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -141.5 15.7 2.18 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.977 0.911 . . . . 0.0 111.097 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -73.1 10.45 0.94 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.793 0.837 . . . . 0.0 111.672 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -140.95 160.7 39.52 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.784 0.834 . . . . 0.0 110.338 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -66.22 -12.2 54.67 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.424 0.69 . . . . 0.0 112.58 -175.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -60.83 -27.0 67.75 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.302 0.501 . . . . 0.0 111.492 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.35 -33.69 61.32 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.669 -0.973 . . . . 0.0 110.669 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.49 -23.02 37.63 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 117.163 0.482 . . . . 0.0 110.841 179.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.05 -43.02 72.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' LEU . . . . . 0.422 ' HB2' ' HE2' ' A' ' 107' ' ' MET . 85.2 mt -70.25 -39.34 75.05 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.112 177.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.93 -35.29 78.19 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.053 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.1 t -65.81 -42.94 90.05 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.477 0.581 . . . . 0.0 110.214 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.9 66.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.592 0.357 . . . . 0.0 111.81 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -110.77 -14.89 13.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 62.0 tp60 -68.33 -38.19 81.29 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.74 -24.99 67.74 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.211 0.078 . . . . 0.0 111.211 176.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 39.8 m -72.04 -12.59 61.29 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 47.0 pt -129.1 8.36 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 118.403 0.547 . . . . 0.0 111.92 -178.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.56 24.72 0.56 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.26 0.624 . . . . 0.0 111.536 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -144.77 -178.32 5.96 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.859 -0.526 . . . . 0.0 111.622 -176.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -61.91 175.96 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.583 1.153 . . . . 0.0 111.808 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.2 m -135.33 155.88 78.36 Favored Pre-proline 0 C--O 1.232 0.156 0 C-N-CA 122.924 0.49 . . . . 0.0 111.064 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.2 176.24 2.12 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.844 3.03 . . . . 0.0 112.472 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -148.55 -2.39 0.5 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.389 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -65.29 -24.85 67.41 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.681 0.393 . . . . 0.0 111.483 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 45.2 mtm -76.18 -36.7 58.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.403 0.281 . . . . 0.0 110.956 -179.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 64.2 mt -77.72 -15.58 59.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.616 -0.678 . . . . 0.0 109.736 175.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -71.11 -21.33 62.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.829 -0.545 . . . . 0.0 109.698 173.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.0 mt -71.56 -14.61 62.14 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 173.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' B' ' 54' ' ' LYS . 28.5 mt -89.73 -16.47 30.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.747 0.249 . . . . 0.0 111.48 174.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -71.09 18.35 0.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.415 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.8 pttt -133.91 2.7 3.41 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.31 0.644 . . . . 0.0 111.918 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -153.04 -3.3 0.22 Allowed 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -132.84 0.26 3.51 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.751 0.705 . . . . 0.0 112.096 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 49.9 tp -77.6 153.34 33.34 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -144.67 169.37 18.12 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 123.364 0.666 . . . . 0.0 110.184 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.4 tp -67.27 -11.72 58.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.061 0.544 . . . . 0.0 111.677 -178.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 13.1 p -150.43 139.39 13.03 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -73.47 178.31 6.84 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.666 2.911 . . . . 0.0 111.194 177.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 . . . . . 0 C--N 1.337 0.06 0 C-N-CA 123.245 0.618 . . . . 0.0 109.888 179.802 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.0 ttm . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 110.63 -0.137 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.2 p -145.52 -11.89 0.52 Allowed 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 122.798 0.439 . . . . 0.0 111.7 176.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.1 tp -85.27 -31.73 22.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 117.997 0.362 . . . . 0.0 111.04 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.83 -30.62 74.54 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -73.11 2.18 7.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.903 0.881 . . . . 0.0 111.269 177.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -130.66 -20.37 2.9 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.461 0.704 . . . . 0.0 111.043 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.53 -32.51 18.15 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.568 0.347 . . . . 0.0 111.313 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.447 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.79 -44.28 96.83 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 72.2 Cg_endo -71.89 -2.32 11.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.098 1.866 . . . . 0.0 112.423 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -135.2 12.73 3.56 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.122 0.569 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.415 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 43.0 tp -57.82 -41.94 92.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.835 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 88.3 Cg_endo -76.67 -10.94 18.61 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.592 1.528 . . . . 0.0 112.275 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -70.78 -21.28 62.52 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-N 118.775 0.716 . . . . 0.0 110.814 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.4 mt -70.79 -28.18 64.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.831 0.287 . . . . 0.0 110.984 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ptm85 -105.04 -13.67 15.67 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 122.243 -0.286 . . . . 0.0 110.728 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -52.68 -25.81 12.02 Favored 'General case' 0 C--N 1.338 0.071 0 C-N-CA 123.911 0.884 . . . . 0.0 110.845 175.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -139.99 -10.1 1.15 Allowed 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 123.102 0.251 . . . . 0.0 111.576 175.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.0 -28.47 63.73 Favored Glycine 0 C--N 1.34 0.76 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 173.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.34 -8.4 39.61 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.199 0.6 . . . . 0.0 111.837 175.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -116.73 0.37 12.56 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.103 0.561 . . . . 0.0 111.622 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -97.61 -3.53 39.36 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.062 0.545 . . . . 0.0 111.379 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -156.59 -5.65 0.11 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.58 26.06 51.77 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 121.891 -0.506 . . . . 0.0 113.778 174.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 t -150.92 127.45 10.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.798 0.799 . . . . 0.0 109.553 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -71.82 -18.66 62.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.112 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -68.32 -42.67 79.04 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -81.17 -31.72 33.92 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 177.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.52 -42.54 93.57 Favored Glycine 0 C--N 1.335 0.515 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -72.51 -30.23 64.3 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 117.595 0.697 . . . . 0.0 110.148 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -71.09 -41.82 70.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.411 -0.328 . . . . 0.0 111.487 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -66.07 -44.21 85.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.412 0.551 . . . . 0.0 111.598 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.7 m -68.52 -34.72 66.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 CA-C-N 118.499 0.59 . . . . 0.0 110.97 -176.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.9 ttp180 -79.45 -32.45 42.68 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.094 -0.379 . . . . 0.0 110.825 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.61 63.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 64.5 m -64.61 -40.38 95.39 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.483 ' O ' HD13 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -77.62 -34.98 53.16 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.73 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -61.67 -24.27 66.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.96 -0.462 . . . . 0.0 110.411 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.15 -16.17 59.24 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.593 0.357 . . . . 0.0 111.04 175.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 20.3 mm -90.57 -18.92 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 58.7 t -64.52 -4.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.277 0.631 . . . . 0.0 110.968 176.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.47 1.68 9.57 Favored 'General case' 0 C--N 1.34 0.177 0 O-C-N 121.697 -0.627 . . . . 0.0 111.195 178.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -158.16 54.35 0.74 Allowed Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 123.239 0.616 . . . . 0.0 111.094 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -72.08 -3.71 13.79 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.981 3.121 . . . . 0.0 112.034 -176.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -106.01 12.59 30.3 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.268 0.627 . . . . 0.0 112.131 -175.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -138.67 7.92 2.56 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -56.15 132.13 74.88 Favored Pre-proline 0 CA--C 1.531 0.237 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -69.97 120.94 7.6 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.346 2.697 . . . . 0.0 112.038 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.4 mmm180 -142.14 6.17 1.73 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.96 1.304 . . . . 0.0 110.205 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -82.53 13.3 3.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.117 0.967 . . . . 0.0 111.068 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.65 -166.73 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 125.03 1.332 . . . . 0.0 108.654 -177.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.54 144.09 18.35 Favored Pre-proline 0 N--CA 1.455 -0.195 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -65.87 2.02 1.96 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.899 2.399 . . . . 0.0 112.259 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -121.64 -18.35 7.19 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 123.616 0.766 . . . . 0.0 111.162 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -74.34 -31.21 62.34 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.262 0.483 . . . . 0.0 110.325 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.46 -33.99 68.05 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.74 -44.54 95.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -80.5 -19.87 44.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.315 -0.374 . . . . 0.0 111.782 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 24.3 tpt180 -70.48 -47.31 61.17 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.643 0.656 . . . . 0.0 110.548 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -71.34 -33.7 69.84 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.098 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -66.72 -39.85 88.16 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.288 -0.258 . . . . 0.0 111.314 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -68.41 -24.72 64.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.75 -37.57 84.48 Favored Glycine 0 C--N 1.339 0.717 0 N-CA-C 111.394 -0.683 . . . . 0.0 111.394 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.2 mm -73.48 -41.6 56.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.127 0 CA-C-N 117.84 0.82 . . . . 0.0 110.166 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.4 t90 -67.54 -38.17 83.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.713 0.233 . . . . 0.0 110.934 -176.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.05 -29.0 62.65 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.241 -0.287 . . . . 0.0 111.108 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 40.2 t -80.08 -30.68 39.27 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 117.539 0.154 . . . . 0.0 110.938 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.77 -31.0 59.33 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.411 -0.181 . . . . 0.0 111.182 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -85.33 -12.45 52.23 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 122.172 -0.33 . . . . 0.0 111.335 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.23 0.03 26.74 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -140.34 4.51 2.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.665 0.386 . . . . 0.0 111.362 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.13 6.21 88.33 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.941 -0.366 . . . . 0.0 112.809 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -75.59 5.14 6.41 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 117.664 0.732 . . . . 0.0 111.807 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -150.78 172.2 15.98 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.077 0.465 . . . . 0.0 111.131 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -146.66 -167.13 2.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.06 1.344 . . . . 0.0 108.729 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 10.4 t -138.9 164.17 30.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.993 0.517 . . . . 0.0 110.03 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.0 t -158.43 -172.72 3.97 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.398 0.679 . . . . 0.0 109.774 -176.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -148.58 8.55 0.79 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.5 m -146.14 142.13 28.18 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.896 0.771 . . . . 0.0 111.499 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -154.13 10.91 0.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.313 1.045 . . . . 0.0 110.403 175.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -153.81 -174.89 5.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.622 0.769 . . . . 0.0 109.582 -176.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -126.17 11.25 7.56 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.106 0.562 . . . . 0.0 110.764 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -166.18 9.71 0.06 OUTLIER Glycine 0 CA--C 1.527 0.843 0 CA-C-O 119.23 -0.761 . . . . 0.0 112.653 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.2 p -139.68 -7.58 1.27 Allowed 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.567 1.184 . . . . 0.0 112.917 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -137.93 -39.18 0.56 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.75 -25.41 67.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.9 p -66.66 -31.02 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 C-N-CA 122.542 0.337 . . . . 0.0 110.565 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.2 -1.08 52.13 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.223 0.609 . . . . 0.0 111.568 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -130.55 -15.07 3.61 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.49 0.316 . . . . 0.0 111.698 177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.92 -1.93 18.84 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.871 0.468 . . . . 0.0 110.468 174.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.556 ' C ' HD22 ' A' ' 91' ' ' LEU . 90.8 mtt-85 -129.25 -15.64 4.11 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.994 0.518 . . . . 0.0 111.536 178.161 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.556 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.5 mm? -138.02 36.44 2.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.114 0.966 . . . . 0.0 110.59 -172.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.88 7.77 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 82.3 mmt-85 -130.68 4.35 4.59 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.062 0.846 . . . . 0.0 112.361 -177.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 57.2 ttm -65.79 143.69 57.34 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.369 0.531 . . . . 0.0 111.168 -178.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 m -61.37 139.12 94.82 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.926 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -66.62 5.45 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 124.246 3.297 . . . . 0.0 113.564 -177.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.97 -35.03 2.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.5 m -62.42 -19.65 63.69 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.0 -0.437 . . . . 0.0 109.86 171.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -58.26 -41.34 84.06 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.664 0.786 . . . . 0.0 110.72 174.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -77.47 -38.49 49.17 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.73 74.43 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 122.243 -0.286 . . . . 0.0 110.825 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -66.56 -48.65 68.97 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.3 mt -67.93 -14.95 63.37 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.882 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.0 mt -98.72 -4.82 32.73 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.911 0.484 . . . . 0.0 111.909 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -136.27 10.24 3.24 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.99 4.94 2.31 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.9 mtm -140.8 -5.02 1.18 Allowed 'General case' 0 C--N 1.339 0.109 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -150.25 -5.88 0.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.382 0.992 . . . . 0.0 112.987 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.95 25.25 65.77 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-O 119.009 -0.884 . . . . 0.0 113.828 175.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -55.38 150.16 11.99 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.641 1.22 . . . . 0.0 110.08 177.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 69.7 m -68.39 153.26 95.86 Favored Pre-proline 0 CA--C 1.529 0.172 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.78 -28.62 39.09 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 123.188 2.592 . . . . 0.0 112.807 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -72.84 -32.82 65.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.23 -0.293 . . . . 0.0 110.772 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -83.52 -36.01 24.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 122.367 -0.208 . . . . 0.0 110.499 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.02 70.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 122.396 -0.19 . . . . 0.0 110.99 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.55 -28.58 33.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.66 0.384 . . . . 0.0 111.252 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -71.34 -27.62 63.5 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.651 0.78 . . . . 0.0 111.59 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.9 mt -85.78 -0.16 54.53 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ILE . . . . . 0.438 HG13 HG22 ' A' ' 121' ' ' VAL . 20.0 pt -135.42 9.86 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 118.509 0.595 . . . . 0.0 111.575 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 55.34 53.92 9.31 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.498 1.119 . . . . 0.0 113.87 175.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.438 HG22 HG13 ' A' ' 119' ' ' ILE . 23.3 m -134.79 174.94 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 C-N-CA 122.895 0.478 . . . . 0.0 110.023 174.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -76.29 158.37 31.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 37.2 m -59.87 -36.61 77.28 Favored 'General case' 0 C--N 1.334 -0.098 0 O-C-N 122.109 -0.37 . . . . 0.0 111.149 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 93.4 p -76.88 -20.92 55.7 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 121.79 -0.569 . . . . 0.0 111.1 -178.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.0 -44.02 55.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.059 178.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.07 -31.23 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.238 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -62.4 -35.32 78.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.707 0.23 . . . . 0.0 110.408 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.6 m -75.63 -36.65 60.16 Favored 'General case' 0 N--CA 1.457 -0.097 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 178.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.1 mp -67.37 -36.58 81.65 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 119.263 -0.399 . . . . 0.0 111.191 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.9 m -76.47 -26.09 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.128 0 CA-C-N 118.937 0.789 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 82.5 m -66.59 -35.79 81.06 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -80.85 -26.77 36.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.364 -0.21 . . . . 0.0 110.623 177.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.53 73.1 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.43 -0.169 . . . . 0.0 110.63 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -78.18 -22.33 48.78 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.916 -0.49 . . . . 0.0 110.333 177.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.82 -38.71 70.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.214 -0.304 . . . . 0.0 110.466 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -78.85 -18.83 53.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.349 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 5.6 mm -63.68 -51.16 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.12 -17.04 61.44 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -71.89 -17.67 62.1 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -149.82 -41.98 0.14 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.0 p 45.81 -7.49 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 117.367 2.358 . . . . 0.0 117.367 -175.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.08 2.73 0.08 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 120.14 1.337 . . . . 0.0 114.386 -177.13 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -71.99 155.5 40.27 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 118.774 0.715 . . . . 0.0 110.671 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.56 6.55 0.47 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.814 0.446 . . . . 0.0 111.766 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -147.61 17.32 1.15 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.739 0.415 . . . . 0.0 110.192 -177.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 48.9 tp -59.23 154.4 16.41 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.692 0.797 . . . . 0.0 111.251 -178.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.467 HG12 ' H ' ' A' ' 149' ' ' ARG . 45.9 t -142.84 136.03 13.99 Favored Pre-proline 0 N--CA 1.455 -0.176 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.52 0.15 7.33 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.861 3.041 . . . . 0.0 113.236 -177.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ARG . . . . . 0.467 ' H ' HG12 ' A' ' 147' ' ' VAL . 61.9 ttt-85 45.69 35.09 1.99 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.462 1.105 . . . . 0.0 111.851 -177.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -77.16 3.52 57.72 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 123.534 0.588 . . . . 0.0 112.367 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 82.5 p -150.72 171.3 17.38 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.699 0.75 . . . . 0.0 110.48 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -152.62 168.54 25.28 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 123.391 0.677 . . . . 0.0 109.691 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -143.19 8.83 1.64 Allowed 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.921 0.488 . . . . 0.0 111.369 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 53.7 m80 56.52 6.8 0.3 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.915 1.286 . . . . 0.0 113.253 -177.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -159.53 148.57 18.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.716 0.806 . . . . 0.0 109.205 177.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -150.99 168.09 25.62 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.553 0.741 . . . . 0.0 109.83 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 44.9 p-80 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.082 -1.437 . . . . 0.0 110.565 -179.011 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 120.659 0.266 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 42.0 tp -151.05 158.41 44.05 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -70.13 -9.62 56.18 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 66.7 mt -147.95 159.11 41.11 Favored Pre-proline 0 C--O 1.233 0.218 0 C-N-CA 124.093 0.957 . . . . 0.0 109.294 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.22 163.37 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 123.915 3.077 . . . . 0.0 112.547 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.98 171.17 42.57 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 178.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 45.9 t30 54.97 179.8 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.598 1.159 . . . . 0.0 111.817 -176.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 64.0 mttp 46.92 32.61 1.9 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.086 0.954 . . . . 0.0 112.571 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -140.8 16.69 2.32 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.02 0.528 . . . . 0.0 110.836 -177.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -60.22 -11.33 6.03 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.127 0.571 . . . . 0.0 112.539 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -66.49 -20.28 66.0 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.333 0.653 . . . . 0.0 111.051 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . 52.82 -173.77 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.67 1.188 . . . . 0.0 112.809 -176.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 79.4 p -148.03 5.95 0.77 Allowed 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 122.613 0.365 . . . . 0.0 111.836 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 29.0 m -65.32 163.97 14.45 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.021 0.528 . . . . 0.0 111.272 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -65.37 151.81 45.37 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.852 0.461 . . . . 0.0 110.109 178.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -144.37 169.22 18.34 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.949 0.9 . . . . 0.0 109.791 -179.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 49.6 m -64.13 161.92 35.97 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.172 0.589 . . . . 0.0 110.967 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -52.17 166.34 0.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.242 3.295 . . . . 0.0 113.118 174.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.24 70.88 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.72 0.408 . . . . 0.0 111.402 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' LYS . . . . . 0.401 ' HD2' ' HA ' ' B' ' 20' ' ' LYS . 20.1 tptm 36.81 55.97 1.18 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 125.439 1.496 . . . . 0.0 112.717 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 33.6 m -60.17 176.38 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 123.749 0.82 . . . . 0.0 111.903 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -141.11 10.54 2.15 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.519 0.728 . . . . 0.0 111.316 -177.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 48.5 m -145.03 166.27 25.82 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 123.205 0.602 . . . . 0.0 110.135 -177.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -143.17 10.91 1.74 Allowed 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 122.993 0.517 . . . . 0.0 111.482 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -62.86 -8.18 6.49 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.941 0.496 . . . . 0.0 111.961 -178.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -67.88 -8.06 33.42 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 123.154 0.581 . . . . 0.0 111.956 178.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -64.01 -9.44 15.97 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.3 tpt -62.14 -28.7 69.83 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.108 0.413 . . . . 0.0 110.359 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.98 62.89 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -17.44 62.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.157 0.479 . . . . 0.0 111.103 178.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.98 -41.69 20.4 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 20.0 mt -70.82 -37.76 73.24 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.64 -29.14 69.1 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.357 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t -67.29 -40.39 86.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.746 0.703 . . . . 0.0 110.277 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.75 -24.23 64.42 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -105.55 -12.49 15.94 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -72.38 -37.99 68.59 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -65.33 -21.86 66.75 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.804 -0.141 . . . . 0.0 110.789 177.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 60.8 m -73.89 -13.23 60.88 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 117.628 0.195 . . . . 0.0 111.282 174.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 63.6 mt -98.26 -23.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 O-C-N 121.933 -0.479 . . . . 0.0 109.934 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.78 27.2 0.18 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.757 0.823 . . . . 0.0 112.103 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -139.57 175.9 9.18 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -64.68 177.62 0.9 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.193 0.997 . . . . 0.0 112.023 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.11 154.28 77.32 Favored Pre-proline 0 C--O 1.233 0.23 0 C-N-CA 123.774 0.829 . . . . 0.0 109.794 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -76.25 -26.59 8.85 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.912 2.408 . . . . 0.0 113.341 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p30 45.15 0.98 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.254 2.222 . . . . 0.0 116.599 -177.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.78 -17.06 64.68 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.243 0.929 . . . . 0.0 111.534 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 17.9 mtm -68.33 -42.03 79.93 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.87 -16.32 57.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -67.71 -21.79 65.29 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.834 -0.541 . . . . 0.0 109.819 173.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.73 -28.86 65.04 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 173.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.96 -14.33 60.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 121.266 -0.174 . . . . 0.0 111.442 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -67.68 -1.05 4.6 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.123 0.42 . . . . 0.0 110.34 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -96.27 -10.15 28.61 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.207 0.603 . . . . 0.0 112.164 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -156.28 -1.1 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.12 8.74 2.73 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 119.062 0.846 . . . . 0.0 112.74 -178.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.91 169.38 20.69 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.238 0.472 . . . . 0.0 110.536 178.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -144.6 179.51 7.24 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.3 1.04 . . . . 0.0 109.645 -178.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -60.64 163.76 5.19 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.271 0.557 . . . . 0.0 111.556 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.5 p -58.75 136.38 86.76 Favored Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.515 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -73.33 171.08 18.39 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.606 2.871 . . . . 0.0 111.189 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 53.7 ptt85 . . . . . 0 CA--C 1.527 0.083 0 C-N-CA 123.507 0.723 . . . . 0.0 110.78 179.93 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.476 0.843 0 CA-C-O 119.458 -0.306 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 t -157.14 -2.9 0.11 Allowed 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.51 -37.49 85.16 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.389 -0.819 . . . . 0.0 110.817 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.19 -28.24 71.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -77.94 1.49 20.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.414 0.686 . . . . 0.0 111.443 179.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -130.2 -3.66 4.43 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.235 0.614 . . . . 0.0 111.71 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.4 mt -111.19 -25.71 9.57 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.519 -0.277 . . . . 0.0 111.157 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.429 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -64.0 -43.96 76.65 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 98.5 Cg_endo -74.4 -1.37 10.92 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.52 2.147 . . . . 0.0 113.156 -175.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -134.99 12.26 3.61 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.929 0.492 . . . . 0.0 110.637 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.418 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 43.1 tp -64.47 -39.54 42.36 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 124.847 1.259 . . . . 0.0 114.207 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 90.6 Cg_endo -77.9 -26.22 6.9 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 CA-C-N 120.666 1.274 . . . . 0.0 112.436 -172.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -51.52 -38.34 53.69 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.606 0.639 . . . . 0.0 111.981 -173.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.7 mt -67.54 -19.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -112.56 -32.55 6.43 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -73.98 -6.96 50.53 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.268 0.227 . . . . 0.0 111.235 -177.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -136.8 -13.35 1.69 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.728 0.411 . . . . 0.0 110.785 167.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -57.45 -33.57 66.61 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -59.86 -24.2 64.04 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 117.931 0.865 . . . . 0.0 111.848 177.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.76 0.94 57.46 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.254 0.622 . . . . 0.0 110.654 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -120.86 4.83 10.49 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.508 1.123 . . . . 0.0 110.474 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.9 p -139.22 -15.04 1.12 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.65 -2.99 87.64 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.456 -0.635 . . . . 0.0 113.146 177.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.6 t -159.95 136.06 8.71 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.243 1.022 . . . . 0.0 111.099 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -66.2 -19.09 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.37 -0.206 . . . . 0.0 111.344 175.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -75.34 -28.31 59.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 117.92 0.327 . . . . 0.0 110.198 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -78.11 -37.25 46.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.21 -29.99 75.05 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -69.55 -41.74 75.5 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.244 0.522 . . . . 0.0 110.887 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.29 -24.03 27.89 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 118.906 -0.569 . . . . 0.0 112.27 -175.37 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -72.77 -36.34 67.63 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 119.309 0.959 . . . . 0.0 109.925 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.6 t -64.89 -43.17 96.33 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 CA-C-N 117.856 0.298 . . . . 0.0 110.618 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -77.31 -28.39 53.22 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 121.279 -0.169 . . . . 0.0 111.266 -178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.48 -27.68 58.92 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.228 0.211 . . . . 0.0 110.589 175.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 53.0 m -63.95 -39.24 93.69 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.73 -45.9 56.32 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -58.31 -30.25 66.53 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.79 0.436 . . . . 0.0 111.773 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.56 0.45 22.96 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.794 0.438 . . . . 0.0 111.918 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.411 HD13 ' CD2' ' A' ' 46' ' ' PHE . 73.1 mt -124.72 -13.9 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 C-N-CA 123.909 0.884 . . . . 0.0 110.177 -177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.0 t -61.48 -14.45 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.312 0.645 . . . . 0.0 111.09 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.76 5.6 9.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.582 0.753 . . . . 0.0 110.562 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.83 51.75 0.77 Allowed Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 123.335 0.654 . . . . 0.0 111.51 -175.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.46 -8.01 19.5 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.176 2.584 . . . . 0.0 111.856 -178.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -82.1 3.37 27.22 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.956 0.902 . . . . 0.0 110.734 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -114.29 9.07 16.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.052 0.541 . . . . 0.0 111.316 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.411 ' CD2' HD13 ' A' ' 39' ' ' ILE . 1.0 OUTLIER -129.59 64.5 71.86 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 122.285 0.234 . . . . 0.0 110.489 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.91 170.5 15.4 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.923 3.082 . . . . 0.0 111.334 -178.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.417 ' C ' ' H ' ' A' ' 50' ' ' VAL . 31.1 mmm180 -125.62 12.8 8.04 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.934 0.894 . . . . 0.0 110.589 -177.082 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -73.35 18.78 0.11 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.47 1.108 . . . . 0.0 111.337 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.417 ' H ' ' C ' ' A' ' 48' ' ' ARG . 27.8 m -136.73 178.6 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 124.7 1.2 . . . . 0.0 109.511 -176.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -54.55 149.4 21.32 Favored Pre-proline 0 C--O 1.233 0.209 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.3 5.93 1.7 Allowed 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.144 2.562 . . . . 0.0 111.953 -176.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -128.16 -24.06 3.2 Favored 'General case' 0 C--O 1.228 -0.033 0 C-N-CA 123.764 0.825 . . . . 0.0 111.35 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.9 tp -66.99 -32.41 73.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.333 0.515 . . . . 0.0 110.287 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -72.91 -34.78 58.69 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.51 -43.22 90.78 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -73.97 -34.5 64.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.475 0.176 . . . . 0.0 111.475 -177.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 48.3 tpt85 -72.47 -37.43 68.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -174.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.0 mmm -76.8 -31.98 57.34 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.18 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -67.09 -35.03 78.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 174.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -64.46 -31.03 72.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.531 0.332 . . . . 0.0 110.236 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.02 -43.84 90.0 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.6 mm -72.98 -39.07 57.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 117.353 0.577 . . . . 0.0 110.099 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -68.25 -41.65 80.83 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.41 -0.181 . . . . 0.0 111.132 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.91 -32.64 74.03 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.186 0.448 . . . . 0.0 110.648 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.1 t -70.12 -25.94 63.72 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 117.515 0.143 . . . . 0.0 110.663 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.59 -36.02 17.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.493 0.317 . . . . 0.0 111.668 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.5 -15.81 61.79 Favored 'General case' 0 C--O 1.226 -0.14 0 O-C-N 121.973 -0.454 . . . . 0.0 110.522 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.96 7.6 8.64 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 111.471 177.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -130.79 -5.24 4.05 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.45 -9.9 3.49 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 114.747 0.659 . . . . 0.0 114.747 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -72.84 6.3 2.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.369 1.084 . . . . 0.0 112.489 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.1 24.0 0.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.516 1.126 . . . . 0.0 112.749 -174.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -154.1 168.61 25.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.253 0.621 . . . . 0.0 110.392 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.7 t 43.58 39.83 2.55 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.269 1.427 . . . . 0.0 112.47 -179.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.1 p -132.17 9.52 4.45 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.44 -14.47 61.26 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 85.8 p -163.72 166.32 22.26 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.798 -0.564 . . . . 0.0 111.969 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -146.1 23.19 1.36 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.091 0.957 . . . . 0.0 110.547 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -142.96 -179.35 6.31 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.109 0.564 . . . . 0.0 110.504 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -136.92 14.76 3.09 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.941 0.497 . . . . 0.0 111.51 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.44 -0.61 0.23 Allowed Glycine 0 CA--C 1.527 0.832 0 CA-C-O 119.516 -0.602 . . . . 0.0 114.061 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -152.2 8.56 0.48 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.386 1.093 . . . . 0.0 112.198 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -139.01 -28.98 0.78 Allowed 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.067 0.547 . . . . 0.0 109.99 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.29 67.69 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 174.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 10.5 p -67.03 -28.87 44.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-O 120.696 0.284 . . . . 0.0 110.318 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 0.74 51.78 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.34 0.656 . . . . 0.0 111.89 -177.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.89 -17.83 3.1 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-N 118.121 0.419 . . . . 0.0 111.815 176.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.14 -1.79 24.75 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.586 0.355 . . . . 0.0 110.679 174.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.538 ' O ' HD12 ' A' ' 91' ' ' LEU . 94.7 mtt-85 -128.58 -12.22 4.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.621 0.768 . . . . 0.0 111.564 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 90' ' ' ARG . 10.0 mp -131.15 24.11 4.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.5 1.12 . . . . 0.0 109.856 -174.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.0 7.26 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.384 1.474 . . . . 0.0 114.826 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -130.32 -0.15 4.55 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.879 0.763 . . . . 0.0 111.677 -177.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.3 ttm -67.09 147.67 52.86 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 122.079 -0.388 . . . . 0.0 110.514 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 32.1 m -65.85 140.74 97.36 Favored Pre-proline 0 CA--C 1.531 0.236 0 C-N-CA 123.444 0.698 . . . . 0.0 110.594 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 65.9 Cg_exo -53.63 2.89 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.474 1 C-N-CA 125.475 4.117 . . . . 0.0 116.313 177.3 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.2 tp -133.18 -20.03 2.17 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 119.056 0.844 . . . . 0.0 111.586 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.9 m -70.2 -19.4 63.17 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 122.051 -0.405 . . . . 0.0 110.919 176.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -65.47 -45.21 84.59 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.437 0.295 . . . . 0.0 110.973 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.401 ' H ' ' HG2' ' A' ' 100' ' ' GLN . 16.3 pt20 -83.26 -25.8 31.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.991 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.62 79.42 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.366 0.53 . . . . 0.0 109.785 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 tp -67.74 -37.59 82.38 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.994 0.518 . . . . 0.0 109.91 177.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 57.3 tp -66.27 -21.34 66.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 122.562 0.345 . . . . 0.0 110.729 177.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.44 HD12 ' HB2' ' A' ' 115' ' ' ALA . 0.2 OUTLIER -90.96 -14.98 30.52 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.207 0.603 . . . . 0.0 111.778 -177.38 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.9 p -134.49 4.86 3.42 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -173.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -123.68 -6.98 7.99 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 118.532 0.605 . . . . 0.0 110.771 174.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 21.7 mtm -143.25 0.6 1.18 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -175.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -135.48 -19.96 1.62 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.157 0.435 . . . . 0.0 111.786 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 59.97 17.41 43.8 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 119.118 -0.823 . . . . 0.0 114.501 172.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.415 ' HB2' ' CD1' ' A' ' 104' ' ' LEU . 16.7 m-30 -68.67 162.32 26.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.119 1.46 . . . . 0.0 109.716 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 41.4 t -66.1 145.91 99.01 Favored Pre-proline 0 N--CA 1.456 -0.155 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 175.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.27 -20.39 14.76 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 122.893 2.395 . . . . 0.0 112.656 174.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.2 -31.13 65.6 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 122.44 0.296 . . . . 0.0 111.05 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -80.78 -36.31 31.98 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.44 ' HB2' HD12 ' A' ' 104' ' ' LEU . . . -66.23 -32.93 74.65 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.662 0.385 . . . . 0.0 110.517 175.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -72.46 -32.45 66.27 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 122.33 0.252 . . . . 0.0 110.823 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -73.76 -22.9 59.7 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 110.758 176.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 28.2 tp -84.26 -9.95 58.07 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -177.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.7 pt -135.25 11.75 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.386 0.539 . . . . 0.0 111.351 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 53.52 59.56 4.27 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.65 1.18 . . . . 0.0 113.96 176.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.4 m -137.77 -179.83 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 C-N-CA 123.683 0.793 . . . . 0.0 109.67 175.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -79.58 156.31 27.76 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.5 m -59.17 -37.27 76.96 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 122.141 -0.349 . . . . 0.0 110.77 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.3 t -72.58 -24.49 61.11 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.316 0.247 . . . . 0.0 111.38 -177.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -69.45 -39.76 77.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.726 -0.609 . . . . 0.0 109.794 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.1 t -64.25 -40.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.107 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -58.73 -37.13 75.51 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 122.929 0.143 . . . . 0.0 110.618 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.9 m -77.86 -38.79 45.28 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.2 mt -64.85 -36.06 83.12 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -177.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 32.2 m -82.86 -28.92 8.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.111 0 CA-C-N 118.343 0.52 . . . . 0.0 111.184 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 54.6 m -68.76 -38.98 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 117.843 0.292 . . . . 0.0 110.224 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -75.79 -27.63 58.05 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.597 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.57 -52.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.356 -0.215 . . . . 0.0 110.88 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -71.19 -22.35 62.04 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.41 78.63 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 175.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -74.94 -18.65 60.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.57 -0.252 . . . . 0.0 110.837 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 21.9 mm -74.93 -55.54 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 CA-C-N 118.371 0.532 . . . . 0.0 109.902 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -19.68 65.79 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.071 0.396 . . . . 0.0 111.793 -176.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.5 -22.07 62.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLN . . . . . 0.472 ' HG3' ' H ' ' A' ' 142' ' ' ARG . 11.0 pt20 -162.98 -32.32 0.04 OUTLIER 'General case' 0 C--N 1.34 0.192 0 N-CA-C 115.278 1.585 . . . . 0.0 115.278 -170.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.5 p 44.77 25.04 0.12 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.968 0.907 . . . . 0.0 112.163 -170.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.472 ' H ' ' HG3' ' A' ' 140' ' ' GLN . 73.0 mtt85 -149.02 20.13 0.98 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.381 1.473 . . . . 0.0 110.317 -171.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.44 143.02 25.16 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.26 1.024 . . . . 0.0 113.169 -171.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -157.02 -6.12 0.1 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.851 176.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -158.22 148.69 20.37 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.146 0.578 . . . . 0.0 109.493 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 46.1 tp -163.27 162.54 25.29 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.973 0.909 . . . . 0.0 108.988 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 24.8 m -136.69 146.96 57.59 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 123.025 0.53 . . . . 0.0 110.017 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -80.62 5.66 5.98 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 125.072 3.848 . . . . 0.0 113.408 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -140.48 162.05 36.27 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.885 0.766 . . . . 0.0 111.566 -172.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -165.38 -172.1 32.39 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 -179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 20.1 t -147.94 171.61 15.51 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 117.407 0.603 . . . . 0.0 110.81 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -156.67 159.45 38.42 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.241 0.617 . . . . 0.0 110.114 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 54.8 p-80 -156.14 172.67 18.04 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.319 0.647 . . . . 0.0 110.107 178.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 -146.53 -15.08 0.44 Allowed 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -159.8 166.69 29.86 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.868 0.467 . . . . 0.0 110.425 178.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -152.68 0.61 0.29 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.098 0.559 . . . . 0.0 111.052 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 . . . . . 0 C--O 1.251 1.153 0 C-N-CA 125.055 1.342 . . . . 0.0 111.91 -178.212 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ptp . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 18.4 tp 51.44 32.14 8.28 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.799 0.84 . . . . 0.0 111.459 -177.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -145.5 172.58 13.01 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.67 0.788 . . . . 0.0 110.789 -179.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.56 128.42 86.13 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 122.801 0.441 . . . . 0.0 109.844 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -74.5 166.79 28.63 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 123.044 2.496 . . . . 0.0 111.197 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 175.23 170.44 38.2 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 178.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -159.5 165.63 32.6 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.724 0.41 . . . . 0.0 110.343 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -153.3 154.81 35.32 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.044 0.938 . . . . 0.0 109.18 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -153.66 -179.24 7.62 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.992 0.517 . . . . 0.0 110.779 -176.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -148.19 178.13 8.82 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.633 0.773 . . . . 0.0 109.479 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 13.9 tppt? -140.78 17.15 2.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.596 0.358 . . . . 0.0 111.367 -176.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.5 171.18 15.94 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.857 0.36 . . . . 0.0 110.887 -179.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 80.4 p -156.75 173.97 16.18 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.006 0.922 . . . . 0.0 109.98 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 88.0 p -67.1 165.7 15.36 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 122.629 0.372 . . . . 0.0 111.262 178.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -72.74 -2.01 18.69 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.335 0.654 . . . . 0.0 112.113 176.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 52.79 -170.27 0.04 OUTLIER 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.504 1.122 . . . . 0.0 112.477 -177.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 41.9 m 44.21 54.16 11.57 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.414 1.085 . . . . 0.0 113.391 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.86 166.29 29.44 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.339 2.693 . . . . 0.0 110.563 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -155.6 169.0 25.33 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.607 0.363 . . . . 0.0 111.001 -179.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.9 14.22 0.92 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.903 0.881 . . . . 0.0 111.305 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 32.1 m -141.31 -174.25 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 124.235 1.014 . . . . 0.0 109.886 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.51 171.79 13.85 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.488 0.715 . . . . 0.0 110.691 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 11.2 t -154.77 -170.06 3.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.003 0.521 . . . . 0.0 110.114 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -134.42 174.98 9.94 Favored 'General case' 0 C--O 1.23 0.062 0 C-N-CA 123.93 0.892 . . . . 0.0 109.732 -178.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -61.03 -22.84 64.95 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.987 -178.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 53.1 ptt85 47.0 -33.18 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 130.563 3.545 . . . . 0.0 118.315 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -152.6 -16.41 0.17 Allowed 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 120.053 1.297 . . . . 0.0 111.46 -178.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -66.41 -29.02 69.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.384 0.538 . . . . 0.0 111.207 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.51 -34.74 79.83 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.89 -21.57 65.14 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 122.297 -0.531 . . . . 0.0 110.939 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.88 -36.29 21.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.92 0.391 . . . . 0.0 110.322 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -72.99 -45.82 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.869 0.468 . . . . 0.0 110.733 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.1 tpp85 -73.0 -27.4 61.76 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.002 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 46.8 t -66.52 -36.14 81.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.692 0.678 . . . . 0.0 110.311 177.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.26 -30.05 66.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.125 0.17 . . . . 0.0 110.965 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -91.29 -25.45 19.44 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 122.045 -0.41 . . . . 0.0 111.686 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -69.19 -37.47 78.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.668 0.667 . . . . 0.0 110.988 -178.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -63.22 -20.19 65.21 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 118.213 0.461 . . . . 0.0 110.677 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 9.4 m -86.72 -3.26 59.03 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.652 0.781 . . . . 0.0 111.207 175.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 81.4 mt -119.9 -8.5 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.619 -0.676 . . . . 0.0 111.366 -175.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -70.32 28.38 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.875 0.87 . . . . 0.0 112.122 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.1 179.2 7.04 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.571 -0.706 . . . . 0.0 111.371 -178.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -59.53 178.02 0.17 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.428 1.091 . . . . 0.0 113.543 -176.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -133.7 158.47 75.44 Favored Pre-proline 0 C--O 1.234 0.244 0 C-N-CA 124.175 0.99 . . . . 0.0 109.725 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -75.11 -179.82 5.39 Favored 'Trans proline' 0 N--CA 1.451 -1.018 0 C-N-CA 122.818 2.345 . . . . 0.0 110.357 176.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -148.43 -2.34 0.51 Allowed 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 177.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -66.15 -21.69 66.34 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 121.69 -0.631 . . . . 0.0 111.945 -177.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -67.09 -45.61 76.76 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.455 ' N ' HD22 ' B' ' 49' ' ' LEU . 3.2 mm? -75.98 -20.25 58.04 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.86 -21.4 66.46 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 122.323 -0.236 . . . . 0.0 110.534 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 64.6 mt -71.09 -26.43 63.05 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.329 -0.232 . . . . 0.0 110.44 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.49 ' C ' ' H ' ' B' ' 54' ' ' LYS . 48.6 mt -74.08 -17.28 60.97 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.954 178.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -69.04 17.94 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.065 0.393 . . . . 0.0 111.324 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.49 ' H ' ' C ' ' B' ' 52' ' ' LEU . 51.9 mtmt -118.47 -2.39 11.06 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.192 0.997 . . . . 0.0 110.931 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -153.83 -14.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.62 170.76 7.21 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 118.353 0.524 . . . . 0.0 111.457 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 44.5 tp -149.72 160.62 43.38 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.328 0.651 . . . . 0.0 109.318 179.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -146.09 173.86 11.81 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.024 0.93 . . . . 0.0 109.803 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 48.7 tp -152.53 157.71 41.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 13.9 p -152.24 141.15 14.0 Favored Pre-proline 0 CA--C 1.53 0.211 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -72.68 169.87 20.88 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.323 2.682 . . . . 0.0 111.31 178.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 . . . . . 0 CA--C 1.534 0.332 0 C-N-CA 125.479 1.511 . . . . 0.0 112.647 -179.996 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp -72.33 -24.79 61.36 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.983 0.913 . . . . 0.0 111.525 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -61.57 -32.03 79.86 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.683 -0.636 . . . . 0.0 112.503 -175.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -75.49 1.44 14.15 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 117.74 0.77 . . . . 0.0 111.852 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -134.09 4.97 3.54 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.559 0.744 . . . . 0.0 110.169 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -111.87 -46.89 3.19 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.813 0.845 . . . . 0.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.441 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -60.37 -43.74 93.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -177.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.441 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 75.0 Cg_endo -73.06 -1.49 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.049 1.832 . . . . 0.0 112.495 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -135.03 7.79 3.45 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.02 0.528 . . . . 0.0 110.524 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.417 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 46.4 tp -57.92 -45.15 99.81 Favored Pre-proline 0 N--CA 1.451 -0.397 0 C-N-CA 124.354 1.061 . . . . 0.0 112.904 -178.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 89.2 Cg_endo -77.84 -10.18 16.88 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.935 1.757 . . . . 0.0 112.624 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -65.71 -20.13 66.17 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.953 0.797 . . . . 0.0 111.429 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.1 mt -75.97 -19.09 59.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.72 0.236 . . . . 0.0 110.88 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.28 -18.07 15.63 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.464 0.706 . . . . 0.0 109.666 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.07 -18.74 26.77 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 125.115 1.366 . . . . 0.0 111.231 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -140.39 -14.05 1.0 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 172.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.65 -28.22 71.13 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.21 -10.01 13.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.397 0.679 . . . . 0.0 111.812 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.21 6.31 4.92 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.367 0.667 . . . . 0.0 111.473 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 tp -106.22 -3.91 20.78 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.047 0.539 . . . . 0.0 110.342 178.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 t -147.84 -19.92 0.36 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.022 0.529 . . . . 0.0 111.439 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 22.81 78.67 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.566 -0.574 . . . . 0.0 113.849 172.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.8 t -146.06 134.77 22.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 118.227 1.014 . . . . 0.0 110.204 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -72.14 -26.49 62.12 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.71 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -73.43 -34.04 65.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -77.05 -39.76 48.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 177.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.23 -36.61 92.0 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -72.02 -36.5 69.69 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.667 0.734 . . . . 0.0 111.246 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -22.91 36.57 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.403 -178.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.94 -44.49 63.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.709 0.686 . . . . 0.0 110.357 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.36 -34.69 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-N 118.549 0.613 . . . . 0.0 110.967 -178.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.54 -32.08 47.77 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.937 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.76 -26.71 60.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 175.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 67.4 m -67.01 -37.57 84.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -43.92 44.23 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -62.67 -25.55 68.2 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.96 -0.463 . . . . 0.0 110.571 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.28 0.19 23.05 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.223 0.609 . . . . 0.0 111.648 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.03 -14.31 7.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.41 0.684 . . . . 0.0 109.99 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 38.2 t -58.3 -14.56 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 123.452 0.701 . . . . 0.0 111.527 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.06 2.28 9.28 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.053 0.541 . . . . 0.0 111.53 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.83 54.56 1.05 Allowed Pre-proline 0 CA--C 1.533 0.304 0 C-N-CA 123.008 0.523 . . . . 0.0 111.28 -177.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.08 -10.99 27.74 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.886 2.391 . . . . 0.0 112.479 -177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.97 -9.64 58.83 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.773 0.429 . . . . 0.0 110.906 176.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -96.93 7.21 47.14 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.4 0.68 . . . . 0.0 111.037 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -129.8 60.63 53.04 Favored Pre-proline 0 CA--C 1.533 0.293 0 C-N-CA 122.666 0.386 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.429 ' C ' ' HD3' ' A' ' 48' ' ' ARG . 92.3 Cg_endo -73.7 163.39 37.41 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.785 2.99 . . . . 0.0 111.109 178.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.429 ' HD3' ' C ' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -138.34 3.83 2.39 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.417 0.687 . . . . 0.0 111.072 179.432 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.45 -17.91 63.0 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 m -73.05 -49.14 40.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -164.59 152.3 10.39 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 126.545 1.938 . . . . 0.0 107.127 172.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.9 3.15 4.08 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 123.472 2.781 . . . . 0.0 112.449 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -136.0 -21.25 1.44 Allowed 'General case' 0 C--N 1.341 0.21 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -176.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.6 tp -68.76 -29.52 67.93 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.39 0.541 . . . . 0.0 110.989 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.29 -34.02 33.92 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.52 -42.45 92.28 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.114 0.457 . . . . 0.0 110.185 177.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -77.0 -31.8 56.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.22 -37.86 86.55 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.989 0.359 . . . . 0.0 111.634 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.2 mmm -80.52 -34.76 35.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.314 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -67.38 -42.43 83.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.322 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -72.49 -20.18 61.41 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.434 -0.506 . . . . 0.0 110.584 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.08 -40.36 95.06 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -70.89 -39.0 74.8 Favored 'Isoleucine or valine' 0 C--N 1.338 0.084 0 CA-C-N 117.447 0.624 . . . . 0.0 109.599 177.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -66.93 -40.17 87.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -23.55 62.21 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.415 0.286 . . . . 0.0 111.192 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.4 t -84.14 -20.18 32.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.16 0.184 . . . . 0.0 110.633 177.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.66 -49.14 13.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.379 -0.201 . . . . 0.0 111.385 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.7 p30 -75.2 -13.05 60.42 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.188 -0.32 . . . . 0.0 111.453 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.19 3.21 40.25 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.314 0.646 . . . . 0.0 111.517 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -139.61 3.36 2.08 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.95 0.5 . . . . 0.0 111.359 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.13 4.66 83.94 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 122.978 0.323 . . . . 0.0 112.823 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.48 1.85 18.02 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 117.499 0.65 . . . . 0.0 111.277 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.23 21.42 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.025 0.53 . . . . 0.0 110.608 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -145.6 -176.76 5.25 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.352 1.061 . . . . 0.0 109.084 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -56.62 155.72 7.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.919 0.488 . . . . 0.0 111.137 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.0 p -70.82 168.47 16.69 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.584 0.707 . . . . 0.0 111.895 -177.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -156.15 -166.85 2.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.309 1.043 . . . . 0.0 108.854 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 72.6 p -145.18 168.43 20.41 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.564 0.346 . . . . 0.0 110.98 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -143.06 20.27 1.94 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.256 0.622 . . . . 0.0 111.304 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -130.87 -166.27 1.67 Allowed 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 123.769 0.828 . . . . 0.0 109.882 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -142.39 11.41 1.91 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.75 16.01 0.06 OUTLIER Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.154 -1.022 . . . . 0.0 115.513 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.8 t -147.4 -3.04 0.56 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.173 1.487 . . . . 0.0 113.181 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.49 -31.34 0.11 Allowed 'General case' 0 C--N 1.334 -0.079 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -71.95 -20.17 61.78 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 171.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.3 p -70.24 -29.53 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.04 0.54 55.05 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.646 0.778 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -115.54 -49.02 2.76 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 124.164 0.986 . . . . 0.0 109.937 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.46 -2.17 6.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 112.462 -175.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.2 mtt-85 -128.77 -7.62 5.04 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.171 0.588 . . . . 0.0 111.77 -177.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 mt -140.3 21.99 2.39 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.182 0.593 . . . . 0.0 111.394 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.4 7.63 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.896 1.278 . . . . 0.0 114.078 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -130.2 -3.43 4.45 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.772 0.715 . . . . 0.0 112.649 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 53.4 ttm -73.79 142.65 46.19 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.493 HG23 ' H ' ' A' ' 98' ' ' SER . 12.4 t -61.89 147.35 89.86 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.38 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.59 1.2 0.06 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 125.217 3.945 . . . . 0.0 117.016 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 25.7 tp -129.19 -26.58 2.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.673 1.124 . . . . 0.0 112.739 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.493 ' H ' HG23 ' A' ' 95' ' ' THR . 73.9 m -68.89 -24.02 64.27 Favored 'General case' 0 C--N 1.337 0.062 0 CA-C-N 119.12 0.873 . . . . 0.0 109.751 175.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -72.66 -25.33 61.23 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 122.183 0.193 . . . . 0.0 110.758 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -80.82 -37.41 30.16 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 176.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.81 -29.96 70.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 176.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.22 -48.41 67.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.502 0.321 . . . . 0.0 110.445 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.411 HD12 ' C ' ' A' ' 103' ' ' LEU . 4.2 pp -73.83 -4.72 36.57 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.185 -0.322 . . . . 0.0 111.444 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.2 tp -103.05 -7.31 21.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.214 0.606 . . . . 0.0 112.22 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 82.5 p -140.63 2.05 1.77 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.5 8.51 5.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.807 0.443 . . . . 0.0 110.688 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 5.0 mtm -143.21 -2.7 0.98 Allowed 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.624 0.77 . . . . 0.0 112.338 -178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -139.95 -14.69 1.04 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.471 0.578 . . . . 0.0 112.072 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.56 8.31 25.54 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.015 176.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -63.87 154.81 32.54 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 118.265 1.032 . . . . 0.0 111.312 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 60.9 m -70.79 157.66 89.73 Favored Pre-proline 0 N--CA 1.456 -0.166 0 C-N-CA 123.172 0.589 . . . . 0.0 109.908 178.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -70.23 -16.16 35.5 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.801 2.334 . . . . 0.0 112.076 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.23 -45.01 43.01 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.234 0.47 . . . . 0.0 111.075 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -82.99 -23.61 33.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.39 -30.1 68.94 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 173.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.94 -32.6 63.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -70.28 -22.85 62.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.766 0.427 . . . . 0.0 110.611 175.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.0 tp -83.4 -7.55 59.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.415 HG13 HG22 ' A' ' 121' ' ' VAL . 23.5 pt -134.92 11.41 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.775 -0.578 . . . . 0.0 110.369 175.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 54.04 59.85 3.99 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.998 1.319 . . . . 0.0 113.364 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.415 HG22 HG13 ' A' ' 119' ' ' ILE . 33.5 m -138.0 -176.19 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 C-N-CA 124.702 1.201 . . . . 0.0 109.336 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -88.66 160.21 17.48 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.6 m -55.97 -40.83 73.84 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 122.745 0.418 . . . . 0.0 111.067 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.5 m -69.81 -20.72 63.44 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.926 0.491 . . . . 0.0 111.787 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.48 -34.38 54.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.424 0.556 . . . . 0.0 110.124 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.3 t -64.98 -36.65 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.061 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.49 -38.45 87.37 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.3 m -71.44 -40.55 70.32 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 119.678 -0.201 . . . . 0.0 110.696 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.02 -34.58 78.34 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.001 0.364 . . . . 0.0 111.82 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -81.17 -27.06 10.61 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.414 0.552 . . . . 0.0 111.032 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 61.6 m -68.95 -37.91 79.12 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -77.13 -25.52 52.18 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 122.275 -0.266 . . . . 0.0 110.658 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.67 -48.4 47.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.399 -0.188 . . . . 0.0 110.557 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.4 -22.61 61.85 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.723 0.238 . . . . 0.0 111.235 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.94 71.34 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.737 0.244 . . . . 0.0 110.371 177.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -75.57 -18.95 59.6 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.875 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.9 mm -78.61 -55.18 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.08 -23.26 67.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.677 0.217 . . . . 0.0 111.194 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.84 -24.35 62.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -158.96 -37.33 0.06 Allowed 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -171.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.7 p . . . . . 0 N--CA 1.47 0.556 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 -169.138 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 . . . . . 0 CA--C 1.528 0.115 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -62.82 -27.78 69.55 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.805 -0.559 . . . . 0.0 111.014 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.34 -37.46 62.97 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.46 -22.11 57.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.44 -0.447 . . . . 0.0 110.85 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.48 -44.23 68.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.856 0.36 . . . . 0.0 110.136 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 68.5 mt -73.71 -37.39 65.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 122.744 0.418 . . . . 0.0 110.095 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.25 -37.76 86.27 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.636 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.1 t -69.49 -37.19 77.11 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 117.74 0.246 . . . . 0.0 111.381 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.89 -30.35 71.45 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 120.545 0.212 . . . . 0.0 111.152 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -105.59 -6.58 19.17 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -67.7 -34.43 76.88 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -57.72 -33.76 68.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.441 0.697 . . . . 0.0 110.345 175.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 23.4 m -67.85 -12.47 60.7 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.183 0.593 . . . . 0.0 112.065 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 44.9 mm -110.2 -12.6 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 118.298 0.499 . . . . 0.0 111.165 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -77.62 25.36 0.19 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.194 0.598 . . . . 0.0 110.991 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -141.52 176.05 9.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.226 0.61 . . . . 0.0 111.374 -178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -66.14 178.06 1.25 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.526 1.131 . . . . 0.0 112.326 -177.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -138.25 156.88 73.51 Favored Pre-proline 0 CA--C 1.531 0.216 0 C-N-CA 123.96 0.904 . . . . 0.0 109.923 -178.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -74.55 176.15 10.11 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 123.058 2.505 . . . . 0.0 110.449 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -147.09 -2.21 0.62 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.16 -23.27 67.07 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.807 -0.558 . . . . 0.0 111.802 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.9 mtm -73.16 -35.27 66.42 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 49' ' ' LEU . 67.7 mt -81.55 -12.32 58.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.713 -0.617 . . . . 0.0 110.084 175.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.0 -20.66 61.68 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 171.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.0 -16.24 62.61 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.987 -0.446 . . . . 0.0 110.417 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.433 ' C ' ' H ' ' B' ' 54' ' ' LYS . 29.6 mt -90.51 -17.0 27.82 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 173.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -71.47 16.12 0.11 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.014 0.37 . . . . 0.0 111.468 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.433 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -133.8 9.35 3.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.184 0.993 . . . . 0.0 111.171 177.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 pp -153.83 -11.68 0.14 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.215 0 CA-C-N 119.205 0.911 . . . . 0.0 113.262 -179.305 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.6 p . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.77 -35.43 74.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 122.624 0.37 . . . . 0.0 111.251 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.75 -27.25 73.2 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 -176.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -73.89 -1.16 18.44 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.413 0.606 . . . . 0.0 111.421 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -135.37 4.31 3.15 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.407 0.683 . . . . 0.0 110.797 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tt -114.56 -41.25 3.45 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.975 0.51 . . . . 0.0 110.113 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.439 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.98 -44.65 99.79 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.5 Cg_endo -72.61 -2.49 11.91 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.092 1.861 . . . . 0.0 112.521 -178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -135.01 13.35 3.6 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.995 0.518 . . . . 0.0 110.97 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.431 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 45.9 tp -62.09 -39.57 59.35 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 76.8 Cg_endo -75.77 -11.69 20.1 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.665 1.577 . . . . 0.0 113.316 -176.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.405 ' CE1' HD11 ' B' ' 40' ' ' ILE . 47.8 m-85 -70.26 -22.8 62.84 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.66 0.663 . . . . 0.0 112.553 -173.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.0 -29.8 64.59 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 118.664 0.666 . . . . 0.0 109.59 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -80.51 -28.19 37.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.995 0.518 . . . . 0.0 109.8 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -56.29 -22.53 30.92 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.297 1.039 . . . . 0.0 112.171 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -140.27 -8.83 1.14 Allowed 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 117.812 0.278 . . . . 0.0 111.737 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.86 -28.45 73.06 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -72.29 -4.84 32.03 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.789 0.794 . . . . 0.0 111.655 177.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.45 6.3 5.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.192 0.597 . . . . 0.0 111.374 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.6 tp -99.9 -1.95 36.04 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.208 0.603 . . . . 0.0 110.193 177.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 t -148.05 -0.3 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.889 0.875 . . . . 0.0 110.754 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.98 -0.62 10.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.395 0.998 . . . . 0.0 114.919 173.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.7 m -139.18 134.37 32.69 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.176 1.488 . . . . 0.0 110.086 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -72.31 -23.57 61.19 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.002 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -65.19 -39.19 92.51 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 118.275 0.489 . . . . 0.0 110.501 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -83.43 -31.33 26.68 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.124 0.57 . . . . 0.0 110.127 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.2 -45.68 92.99 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -74.63 -26.4 59.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 117.388 0.594 . . . . 0.0 110.939 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.68 -46.38 72.48 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -64.76 -33.36 75.8 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 117.744 0.247 . . . . 0.0 111.117 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.77 -55.27 24.76 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 117.825 0.284 . . . . 0.0 110.656 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -74.5 -29.17 61.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.119 -176.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -25.04 63.58 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 119.789 -0.148 . . . . 0.0 110.984 177.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.88 -45.67 85.03 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 117.894 0.316 . . . . 0.0 110.231 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.6 tt -80.55 -36.45 33.01 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 119.839 -0.744 . . . . 0.0 111.564 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.94 -27.03 68.54 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.341 0.518 . . . . 0.0 110.242 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.45 -1.19 25.86 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.244 0.618 . . . . 0.0 111.662 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.0 mt -118.98 -13.56 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.725 0.81 . . . . 0.0 110.082 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -58.59 -12.31 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.694 0.798 . . . . 0.0 111.799 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.26 3.3 9.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.321 0.649 . . . . 0.0 111.42 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.41 55.26 1.03 Allowed Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.561 0.745 . . . . 0.0 110.531 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.87 -8.93 21.2 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.512 2.808 . . . . 0.0 112.759 -174.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -80.47 -8.58 59.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.776 0.43 . . . . 0.0 111.403 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -88.44 -17.18 30.97 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.294 0.237 . . . . 0.0 111.633 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.52 120.2 80.66 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -53.69 139.68 67.32 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.282 2.655 . . . . 0.0 112.389 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 54.3 mmm-85 -141.69 16.63 2.16 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.779 1.232 . . . . 0.0 110.084 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -128.17 20.85 6.3 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.95 0.9 . . . . 0.0 110.78 -175.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.2 m -139.37 -178.28 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 124.528 1.131 . . . . 0.0 108.999 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -53.79 146.96 24.75 Favored Pre-proline 0 CA--C 1.531 0.233 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.9 11.31 0.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 123.884 3.056 . . . . 0.0 111.676 -176.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -127.94 -22.21 3.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.631 0.773 . . . . 0.0 111.022 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.8 tp -74.42 -34.36 63.21 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.173 0.442 . . . . 0.0 110.251 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.71 -30.4 61.89 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.43 -43.58 93.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.203 0.601 . . . . 0.0 110.111 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -81.01 -29.78 35.08 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -177.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.24 -40.63 90.37 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 117.897 0.317 . . . . 0.0 111.129 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.3 mmm -74.94 -35.74 62.13 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -66.75 -35.91 81.21 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 117.529 0.149 . . . . 0.0 110.647 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -68.71 -27.36 65.88 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.866 0.466 . . . . 0.0 110.017 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.58 -37.32 84.96 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.593 -0.603 . . . . 0.0 111.593 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.7 mm -72.39 -38.91 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.067 0 CA-C-N 118.014 0.907 . . . . 0.0 110.323 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -69.74 -35.5 75.03 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.23 -0.294 . . . . 0.0 110.584 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.31 -28.15 66.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 122.166 -0.333 . . . . 0.0 110.58 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -80.34 -28.06 38.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.429 0.291 . . . . 0.0 110.878 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.63 -32.26 67.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.227 -0.295 . . . . 0.0 111.11 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -87.01 -12.49 47.26 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.406 0.282 . . . . 0.0 110.876 177.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.8 5.55 43.09 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.183 0.593 . . . . 0.0 110.877 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -134.99 1.75 3.03 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.27 0.628 . . . . 0.0 111.027 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.58 25.97 74.97 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-O 119.618 -0.545 . . . . 0.0 112.572 176.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -61.58 -16.35 47.31 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.847 0.823 . . . . 0.0 111.17 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.23 164.2 39.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.561 0.744 . . . . 0.0 110.305 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -141.35 4.27 1.78 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.844 0.858 . . . . 0.0 110.513 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.1 t -159.27 -172.15 3.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.254 1.021 . . . . 0.0 108.921 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 87.0 p -130.61 -19.0 3.06 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.225 -0.417 . . . . 0.0 111.609 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 58.04 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 174.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 74.2 m 57.41 168.72 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.899 1.28 . . . . 0.0 113.215 -171.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -149.7 16.26 0.88 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.466 0.706 . . . . 0.0 110.936 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.92 -176.39 4.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.925 0.49 . . . . 0.0 110.289 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -138.87 7.56 2.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.753 0.421 . . . . 0.0 111.857 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -172.51 12.42 0.04 OUTLIER Glycine 0 CA--C 1.529 0.918 0 CA-C-O 119.208 -0.774 . . . . 0.0 114.44 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.7 t -145.93 -0.63 0.8 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.845 1.322 . . . . 0.0 112.81 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -149.68 -45.92 0.13 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.08 -24.37 67.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.24 -28.59 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 O-C-N 122.117 -0.364 . . . . 0.0 110.545 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.63 -0.35 56.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.76 -21.09 2.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 118.168 0.44 . . . . 0.0 111.867 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -81.11 -1.94 46.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.071 0.548 . . . . 0.0 110.962 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.443 ' C ' HD12 ' A' ' 91' ' ' LEU . 74.5 mtp180 -129.19 -9.97 4.74 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.111 0.564 . . . . 0.0 111.734 -177.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.443 HD12 ' C ' ' A' ' 90' ' ' ARG . 10.8 mp -126.16 7.01 7.16 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.839 0.856 . . . . 0.0 111.43 -174.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.13 -9.31 1.96 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -75.21 -0.82 20.72 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.017 0.527 . . . . 0.0 111.225 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 72.0 mtm -121.13 162.48 20.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 122.94 0.496 . . . . 0.0 111.238 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 97' ' ' LEU . 28.6 m -67.29 144.21 97.95 Favored Pre-proline 0 N--CA 1.453 -0.303 0 C-N-CA 123.749 0.819 . . . . 0.0 110.585 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 53.9 Cg_exo -54.59 5.26 0.04 OUTLIER 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 124.829 3.686 . . . . 0.0 115.344 173.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.427 ' H ' ' C ' ' A' ' 95' ' ' THR . 3.3 tm? -123.71 -37.25 2.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.462 0.574 . . . . 0.0 110.086 -174.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 p -67.68 -20.79 65.33 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.307 0.503 . . . . 0.0 110.257 175.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 33.6 mtp-105 -71.7 -23.56 61.66 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.656 0.207 . . . . 0.0 110.839 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -78.99 -38.07 37.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -66.27 -29.78 70.07 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.41 ' C ' HD13 ' A' ' 102' ' ' LEU . 3.4 tm? -62.91 -51.3 67.47 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.86 -4.92 37.84 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 71.2 mt -95.3 -7.43 38.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.26 0.482 . . . . 0.0 111.951 174.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 65.1 p -136.07 8.12 3.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.558 0.617 . . . . 0.0 112.488 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.09 7.66 2.68 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.929 0.491 . . . . 0.0 110.847 176.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.5 tpp -136.05 -15.07 1.77 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -150.6 -21.81 0.23 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.437 0.562 . . . . 0.0 112.397 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 84.32 19.86 59.82 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 119.396 -0.669 . . . . 0.0 113.615 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -56.7 148.51 20.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.371 1.085 . . . . 0.0 110.708 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.3 m -72.68 153.41 91.49 Favored Pre-proline 0 CA--C 1.53 0.206 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -52.65 -30.11 44.34 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.459 2.773 . . . . 0.0 113.252 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.03 -33.9 72.59 Favored 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.749 -0.594 . . . . 0.0 110.808 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -83.26 -36.7 24.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.17 -31.04 68.34 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.916 -0.129 . . . . 0.0 111.24 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.32 -36.54 61.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.879 0.309 . . . . 0.0 110.794 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -69.41 -23.07 63.65 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.78 0.432 . . . . 0.0 111.211 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 23.6 tp -87.7 -3.29 58.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.981 0.512 . . . . 0.0 111.782 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.42 HG13 HG22 ' A' ' 121' ' ' VAL . 14.0 pt -134.38 10.66 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.986 -0.446 . . . . 0.0 110.793 178.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 59.43 50.89 7.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.444 1.098 . . . . 0.0 113.561 173.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.42 HG22 HG13 ' A' ' 119' ' ' ILE . 28.7 m -136.03 174.66 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 C-N-CA 123.482 0.713 . . . . 0.0 110.189 175.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.17 157.38 36.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.8 m -59.46 -36.58 76.24 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.138 -0.351 . . . . 0.0 110.99 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.7 t -74.28 -23.81 59.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.004 -0.435 . . . . 0.0 111.072 -179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.35 -42.5 65.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.963 -0.461 . . . . 0.0 110.621 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.4 p -68.11 -29.68 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.454 -178.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.23 -37.94 87.28 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 176.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 88.8 m -77.11 -36.53 55.52 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 122.382 -0.199 . . . . 0.0 110.488 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.14 -30.78 71.33 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.135 -0.459 . . . . 0.0 111.505 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.0 m -82.77 -27.69 8.31 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 118.903 0.774 . . . . 0.0 110.805 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 84.5 m -68.1 -38.71 82.6 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -76.7 -27.02 55.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 122.125 -0.359 . . . . 0.0 110.615 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.42 -49.06 45.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.23 -22.92 63.82 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 122.152 -0.342 . . . . 0.0 111.303 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.79 71.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -75.84 -18.9 59.28 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.532 -0.27 . . . . 0.0 111.105 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.0 mm -75.54 -55.38 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 118.402 0.546 . . . . 0.0 109.597 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -65.34 -18.42 65.3 Favored 'General case' 0 CA--C 1.527 0.083 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -75.19 -22.07 58.26 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -159.71 -37.45 0.06 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -171.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.468 0.47 0 C-N-CA 123.822 0.849 . . . . 0.0 112.517 -169.599 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 CA--C 1.53 0.21 0 CA-C-O 120.59 0.233 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -59.35 -28.06 66.5 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.275 0.63 . . . . 0.0 112.017 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -69.07 -30.46 72.05 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.43 -15.73 48.54 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.738 0.769 . . . . 0.0 110.687 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.33 -46.31 16.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 mt -68.94 -38.7 79.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.695 177.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -67.69 -29.2 68.41 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.155 -0.45 . . . . 0.0 110.921 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.1 t -67.73 -44.45 77.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.728 0.695 . . . . 0.0 110.312 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.2 -24.41 67.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.248 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -107.44 -9.51 15.96 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -70.36 -36.07 73.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 173.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -69.2 -21.23 63.97 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.24 -0.288 . . . . 0.0 111.143 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 58.7 m -75.79 -10.8 59.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.274 0.629 . . . . 0.0 111.389 177.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.405 HD11 ' CE1' ' A' ' 13' ' ' PHE . 19.1 tt -123.94 30.03 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 122.181 0.991 . . . . 0.0 110.018 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -128.41 28.91 5.39 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.43 0.692 . . . . 0.0 109.574 176.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -142.46 -176.24 4.77 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.662 0.785 . . . . 0.0 110.279 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -60.34 178.79 0.18 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.07 0.948 . . . . 0.0 112.91 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.07 155.64 74.35 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.238 -175.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -76.8 59.09 6.24 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 124.499 3.466 . . . . 0.0 110.533 175.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -59.85 -9.51 2.99 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.609 0.764 . . . . 0.0 111.607 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -56.62 -23.37 40.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.242 0.617 . . . . 0.0 111.619 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 19.3 ptp -75.92 -29.08 58.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.844 -0.535 . . . . 0.0 110.813 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 49' ' ' LEU . 64.4 mt -80.39 -11.19 59.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 121.615 -0.678 . . . . 0.0 109.461 174.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.78 -20.29 61.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 168.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 50.4 mt -78.45 -8.53 58.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.432 0.293 . . . . 0.0 110.247 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -90.42 -18.77 24.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 171.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -74.24 13.7 0.53 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.665 0.386 . . . . 0.0 111.251 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -130.97 13.3 5.24 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.119 0.968 . . . . 0.0 109.894 174.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.3 mt -137.5 -26.87 0.97 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.533 0.733 . . . . 0.0 111.394 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.233 0 CA-C-N 117.884 0.311 . . . . 0.0 111.581 -179.861 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 CA--C 1.53 0.208 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.9 tp 61.43 -38.9 0.12 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.476 2.31 . . . . 0.0 114.847 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.6 -24.92 64.05 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 119.105 0.866 . . . . 0.0 112.51 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -68.85 -2.1 8.79 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 117.597 0.698 . . . . 0.0 111.126 177.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -131.01 -21.49 2.67 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.253 0.621 . . . . 0.0 110.974 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 tp -77.91 -44.87 25.74 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.138 -0.351 . . . . 0.0 110.36 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.418 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.29 -46.26 99.84 Favored Pre-proline 0 CA--C 1.534 0.346 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -173.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.418 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 88.4 Cg_endo -74.69 -0.24 9.57 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.307 2.005 . . . . 0.0 112.541 -176.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -133.65 13.29 4.07 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.411 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 42.2 mt -55.05 -43.54 99.12 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.411 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 69.5 Cg_endo -81.12 -12.54 11.74 Favored 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 121.919 1.746 . . . . 0.0 114.016 -170.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -66.03 -23.15 66.5 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 119.123 0.874 . . . . 0.0 111.843 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.417 ' N ' HD12 ' A' ' 14' ' ' LEU . 8.0 mp -69.76 -18.85 63.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 118.089 0.404 . . . . 0.0 110.557 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -98.27 -20.7 17.08 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -58.24 -22.26 51.57 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 123.682 0.793 . . . . 0.0 111.57 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -140.09 -24.93 0.81 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.247 0.219 . . . . 0.0 111.3 177.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -61.33 -29.0 70.27 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -65.47 -32.77 74.57 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.114 0.457 . . . . 0.0 110.635 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.47 -6.21 52.69 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.485 0.314 . . . . 0.0 111.833 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.0 mt -97.44 4.7 50.47 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -155.36 -15.8 0.11 Allowed 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.06 25.34 75.49 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.577 -0.702 . . . . 0.0 112.758 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.4 t -150.67 139.95 21.29 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.188 0.994 . . . . 0.0 110.948 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -81.16 -20.2 41.79 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.425 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -71.82 -36.54 70.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -76.63 -32.3 57.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.22 -43.31 89.55 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -67.92 -31.94 72.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 117.071 0.435 . . . . 0.0 110.633 178.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -71.27 -42.51 68.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.379 0.272 . . . . 0.0 110.406 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -65.3 -41.41 94.13 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.576 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.0 m -68.61 -37.7 78.0 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.127 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.327 -176.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -78.8 -29.8 45.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.577 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.32 -26.58 62.0 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.302 -0.259 . . . . 0.0 110.302 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.2 m -65.59 -40.82 93.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -75.45 -41.78 54.89 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 110.272 -0.269 . . . . 0.0 110.272 -176.814 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.92 -24.95 68.09 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.903 -0.498 . . . . 0.0 110.649 -178.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.75 0.46 26.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.39 0.676 . . . . 0.0 111.594 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.1 mt -122.41 -14.85 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.112 0.965 . . . . 0.0 109.977 -176.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.8 -14.83 7.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.463 0.705 . . . . 0.0 111.053 175.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.69 4.41 9.51 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.413 0.685 . . . . 0.0 110.933 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.74 53.05 0.89 Allowed Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.39 0.676 . . . . 0.0 111.295 -176.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -65.01 -10.72 26.62 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.24 2.627 . . . . 0.0 112.55 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -74.87 -13.84 60.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.53 0.332 . . . . 0.0 111.255 176.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -90.05 2.8 54.8 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.048 0.539 . . . . 0.0 111.533 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -133.77 65.08 69.84 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 122.483 0.313 . . . . 0.0 111.135 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -76.39 179.95 5.89 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 124.681 3.587 . . . . 0.0 111.396 -175.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 78.7 mmt-85 -132.56 16.42 4.4 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.662 1.185 . . . . 0.0 109.823 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -71.86 8.89 1.04 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.185 0.994 . . . . 0.0 110.902 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.63 178.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 C-N-CA 124.974 1.309 . . . . 0.0 108.693 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -53.73 146.09 27.88 Favored Pre-proline 0 CA--C 1.529 0.166 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -70.18 10.77 0.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.979 3.119 . . . . 0.0 111.983 -175.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -132.63 -17.53 2.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.325 0.65 . . . . 0.0 111.127 179.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 54.1 tp -75.93 -36.41 59.4 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.374 0.534 . . . . 0.0 110.558 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.81 -32.07 54.51 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -58.6 -42.84 89.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.768 0.827 . . . . 0.0 109.854 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 -79.61 -28.6 40.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -66.94 -41.27 87.26 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.242 0.474 . . . . 0.0 111.257 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 93.4 mmm -75.37 -32.27 60.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.241 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -68.67 -35.93 77.87 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.92 -26.86 67.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.773 0.429 . . . . 0.0 110.117 177.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.84 -38.36 65.69 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.7 mm -74.44 -35.98 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 CA-C-N 117.886 0.843 . . . . 0.0 110.046 177.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -67.68 -32.15 72.62 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.501 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.22 -32.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.937 -0.477 . . . . 0.0 110.207 175.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.1 t -73.22 -26.37 61.11 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.74 -30.86 51.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.334 0.253 . . . . 0.0 110.454 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -76.65 -15.12 59.9 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.107 -0.371 . . . . 0.0 110.314 173.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -93.05 7.58 43.54 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.608 0.763 . . . . 0.0 110.628 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -138.31 0.54 2.11 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.287 0.635 . . . . 0.0 111.39 -179.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.92 33.2 46.76 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.641 -0.533 . . . . 0.0 112.525 175.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -123.47 10.7 9.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.017 0.909 . . . . 0.0 111.253 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.73 24.28 1.53 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.874 0.469 . . . . 0.0 111.205 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -102.66 6.3 39.55 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.07 0.548 . . . . 0.0 110.809 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.8 t -155.08 174.37 15.27 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.497 0.719 . . . . 0.0 109.824 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -154.15 176.4 12.3 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.305 0.642 . . . . 0.0 110.816 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -145.94 -12.82 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.972 0.509 . . . . 0.0 112.009 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 m 61.5 168.16 0.1 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.663 1.185 . . . . 0.0 112.817 -173.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -144.69 14.42 1.56 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.03 0.932 . . . . 0.0 110.507 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.3 -179.3 6.75 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.919 0.888 . . . . 0.0 109.578 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -136.34 11.98 3.26 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.441 0.296 . . . . 0.0 111.707 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -164.27 12.08 0.09 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 119.394 -0.67 . . . . 0.0 113.827 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -149.78 7.91 0.66 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 1.127 . . . . 0.0 111.63 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -150.3 -48.24 0.13 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.35 -28.21 41.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 122.553 0.341 . . . . 0.0 110.819 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.8 0.76 55.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.096 0.558 . . . . 0.0 111.926 -178.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -121.48 -39.89 2.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.861 0.465 . . . . 0.0 110.012 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.35 -1.31 7.93 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -130.11 -2.95 4.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.221 0.608 . . . . 0.0 111.337 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 61.8 mt -137.52 20.17 2.91 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.918 0.887 . . . . 0.0 111.13 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.06 4.49 0.05 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -175.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -129.4 0.47 5.06 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.091 0.86 . . . . 0.0 112.085 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 54.5 ttm -71.55 149.55 45.61 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.8 m -57.43 140.11 79.92 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 123.648 0.779 . . . . 0.0 109.707 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.54 5.4 0.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.031 3.154 . . . . 0.0 113.919 -176.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.3 tp -128.97 -22.99 3.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.477 0.581 . . . . 0.0 110.682 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 71.0 m -69.32 -22.89 63.75 Favored 'General case' 0 N--CA 1.457 -0.075 0 O-C-N 121.891 -0.505 . . . . 0.0 109.922 174.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 40.4 mtp-105 -68.05 -32.54 72.96 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 175.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -76.39 -39.0 54.88 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.07 -30.45 71.52 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.1 tp -66.84 -46.59 74.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.402 0.281 . . . . 0.0 110.283 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.0 mt -74.89 -8.94 57.97 Favored 'General case' 0 N--CA 1.46 0.04 0 O-C-N 122.13 -0.356 . . . . 0.0 110.73 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -95.67 -8.4 34.83 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -140.65 -20.34 0.83 Allowed 'General case' 0 C--N 1.339 0.121 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.53 -10.85 58.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.121 0.873 . . . . 0.0 111.591 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 16.1 ptp -149.83 11.3 0.74 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -174.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -138.08 -13.13 1.42 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.856 0.753 . . . . 0.0 112.15 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.84 10.04 36.59 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.009 -0.884 . . . . 0.0 114.493 173.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -59.2 150.44 25.53 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 118.808 1.304 . . . . 0.0 110.132 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 94.4 p -67.87 157.19 87.44 Favored Pre-proline 0 N--CA 1.454 -0.235 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.246 179.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -69.45 -16.17 38.7 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 122.775 2.317 . . . . 0.0 110.866 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -79.16 -44.73 21.37 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.63 0.372 . . . . 0.0 110.733 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -78.67 -27.52 45.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.959 -0.463 . . . . 0.0 109.865 177.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.96 -27.64 64.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.905 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.64 -32.55 60.26 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 110.423 -0.214 . . . . 0.0 110.423 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -70.02 -28.95 65.91 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.635 0.374 . . . . 0.0 110.349 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 17.3 tp -76.87 -9.04 58.41 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 21.1 pt -134.98 12.29 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 117.931 0.332 . . . . 0.0 110.812 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 52.34 60.8 3.56 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.904 1.281 . . . . 0.0 113.7 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.36 -175.28 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.43 1.092 . . . . 0.0 109.492 175.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -88.4 160.64 17.48 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.8 m -56.32 -40.49 74.48 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 122.115 -0.365 . . . . 0.0 111.341 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 51.9 m -70.54 -20.54 62.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.688 0.395 . . . . 0.0 111.907 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.91 -37.7 62.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 121.954 -0.466 . . . . 0.0 109.834 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.63 -38.68 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.01 -33.02 74.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.79 -0.078 . . . . 0.0 110.79 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 91.4 m -78.12 -39.66 40.6 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -34.03 77.42 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 119.331 -0.366 . . . . 0.0 111.184 -179.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.5 m -80.49 -27.54 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 CA-C-N 118.515 0.598 . . . . 0.0 110.993 178.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.9 m -69.23 -38.78 78.7 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 178.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -76.04 -25.65 55.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.28 -47.85 46.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 117.674 0.216 . . . . 0.0 110.432 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.7 -22.77 65.25 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.337 0.517 . . . . 0.0 111.264 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -77.41 -34.38 54.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.91 0.386 . . . . 0.0 110.587 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -77.39 -27.46 52.49 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 123.366 0.666 . . . . 0.0 110.094 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.9 mm -66.66 -60.07 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.19 -23.69 67.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -171.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -71.9 -10.2 59.44 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -151.53 -50.07 0.12 Allowed 'General case' 0 C--N 1.34 0.19 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 42.9 p . . . . . 0 N--CA 1.47 0.554 0 C-N-CA 127.698 2.399 . . . . 0.0 117.371 -171.995 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 CA--C 1.527 0.061 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.7 tpt -67.02 -25.23 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.708 0.686 . . . . 0.0 110.707 178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.6 -29.55 65.52 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.14 -27.08 59.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 117.234 0.517 . . . . 0.0 110.549 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.67 -41.52 71.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.38 -43.01 70.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.013 0.525 . . . . 0.0 110.341 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -69.43 -29.79 67.59 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 119.041 -0.505 . . . . 0.0 111.246 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.2 t -65.9 -43.59 87.76 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 118.863 0.756 . . . . 0.0 110.191 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.56 71.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.595 0.236 . . . . 0.0 110.666 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -100.49 -3.13 31.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.183 -0.323 . . . . 0.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -70.42 -31.95 69.36 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -62.86 -33.0 74.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 172.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 20.6 m -81.22 -4.06 54.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.756 0.823 . . . . 0.0 113.101 -177.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 10.4 tp -119.54 -12.02 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 119.166 0.893 . . . . 0.0 112.262 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -83.18 -3.68 57.62 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.897 -0.502 . . . . 0.0 111.172 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.78 170.58 15.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.612 0.72 . . . . 0.0 111.799 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -71.89 -173.76 1.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.068 0.947 . . . . 0.0 110.284 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.9 m -131.58 149.46 73.56 Favored Pre-proline 0 C--O 1.232 0.161 0 C-N-CA 122.608 0.363 . . . . 0.0 110.114 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -76.5 -27.86 7.3 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.291 2.661 . . . . 0.0 113.437 -175.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.5 t70 52.53 -2.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.038 1.735 . . . . 0.0 115.138 -178.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -67.54 -17.04 64.5 Favored 'General case' 0 N--CA 1.457 -0.111 0 O-C-N 121.112 -0.992 . . . . 0.0 111.399 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 28.1 mtm -71.05 -31.25 67.64 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.324 -0.235 . . . . 0.0 110.401 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -85.87 -9.72 56.51 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.977 -0.452 . . . . 0.0 109.959 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -73.13 -20.21 60.97 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.708 -0.62 . . . . 0.0 109.552 169.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 80.9 mt -77.22 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.566 0.346 . . . . 0.0 110.245 173.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -88.51 -18.59 27.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.764 0.425 . . . . 0.0 109.957 171.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -77.89 18.07 0.52 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.196 0.598 . . . . 0.0 111.867 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -133.5 1.35 3.41 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.769 0.428 . . . . 0.0 111.919 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 pp -154.16 2.59 0.24 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.208 0 CA-C-N 118.605 0.639 . . . . 0.0 112.201 179.199 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.4 p . . . . . 0 CA--C 1.529 0.144 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.94 -35.63 66.86 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.79 0.436 . . . . 0.0 111.527 -178.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.53 -36.02 92.81 Favored Glycine 0 C--N 1.341 0.814 0 O-C-N 121.692 -0.63 . . . . 0.0 111.69 -177.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -73.77 1.87 9.54 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.612 0.765 . . . . 0.0 111.309 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -130.84 1.92 4.38 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.674 0.79 . . . . 0.0 110.955 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.34 -38.15 4.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.293 0.637 . . . . 0.0 109.865 177.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.446 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.29 -43.42 96.62 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.7 Cg_endo -73.34 -1.17 10.23 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.357 2.038 . . . . 0.0 112.867 -176.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -134.14 8.74 3.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.248 0.619 . . . . 0.0 110.409 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.75 -41.87 88.17 Favored Pre-proline 0 N--CA 1.452 -0.362 0 C-N-CA 125.362 1.465 . . . . 0.0 114.141 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.28 -10.76 14.84 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.818 1.679 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -66.94 -20.45 65.9 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.753 -0.592 . . . . 0.0 111.059 -177.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.0 mt -71.8 -21.63 61.68 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.095 0.407 . . . . 0.0 110.71 178.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -94.57 -22.19 18.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -55.8 -27.52 51.55 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 124.579 1.152 . . . . 0.0 111.674 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.9 p90 -140.09 -18.89 0.9 Allowed 'General case' 0 N--CA 1.458 -0.074 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.51 -25.74 74.63 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -81.8 -9.52 59.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.377 0.588 . . . . 0.0 110.978 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -109.4 -1.32 18.5 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.616 0.767 . . . . 0.0 110.497 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.5 tp -89.83 5.96 43.88 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.091 0.956 . . . . 0.0 109.444 175.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.2 p -142.28 -14.26 0.79 Allowed 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.696 0.799 . . . . 0.0 111.902 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.482 ' HA3' ' H ' ' A' ' 77' ' ' GLN . . . 64.04 13.86 54.27 Favored Glycine 0 CA--C 1.53 1.031 0 CA-C-O 119.619 -0.545 . . . . 0.0 112.965 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.5 t -142.06 133.25 26.24 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.887 0.843 . . . . 0.0 110.332 -178.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -70.54 -27.16 63.95 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.168 -177.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -75.03 -35.88 61.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.52 -0.112 . . . . 0.0 110.798 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -75.92 -32.4 59.58 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.504 -0.122 . . . . 0.0 110.894 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.3 -42.45 42.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -71.91 -27.89 63.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.591 0.696 . . . . 0.0 111.375 -177.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.71 -26.28 34.76 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.782 0.719 . . . . 0.0 111.747 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -73.8 -31.21 63.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.812 0.733 . . . . 0.0 109.897 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.411 HG12 ' SD ' ' B' ' 48' ' ' MET . 26.6 t -63.92 -51.88 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 177.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -73.99 -27.78 61.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.409 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.98 -25.09 61.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 117.461 0.118 . . . . 0.0 110.734 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 69.3 m -65.02 -45.37 85.81 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 119.093 -0.479 . . . . 0.0 110.327 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.438 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -72.88 -35.18 67.1 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.605 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -62.91 -23.95 67.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.532 -0.73 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.8 -0.1 33.11 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.82 0.448 . . . . 0.0 111.687 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 19.5 mm -110.87 -19.55 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.373 0.669 . . . . 0.0 109.494 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.68 -13.76 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 124.137 0.975 . . . . 0.0 113.076 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 2.24 9.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.859 -0.526 . . . . 0.0 111.181 -178.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -160.55 59.17 1.15 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 C-N-CA 123.136 0.574 . . . . 0.0 110.419 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -65.28 -10.72 27.02 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.441 2.761 . . . . 0.0 112.679 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -76.35 -13.12 60.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.963 0.505 . . . . 0.0 111.446 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -80.11 -22.62 41.94 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.044 0.383 . . . . 0.0 111.463 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -78.36 121.59 83.99 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -50.44 142.55 29.87 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.558 2.839 . . . . 0.0 112.998 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.0 mmt85 -134.98 8.94 3.52 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.934 0.894 . . . . 0.0 109.433 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -139.69 20.82 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.506 1.122 . . . . 0.0 110.819 -173.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 51' ' ' ASP . 4.5 t -133.4 170.57 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.418 ' H ' HG12 ' A' ' 50' ' ' VAL . 9.5 m-20 -53.26 144.54 29.53 Favored Pre-proline 0 N--CA 1.455 -0.209 0 O-C-N 122.127 -0.358 . . . . 0.0 110.604 -179.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.9 11.87 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 124.176 3.251 . . . . 0.0 112.008 -175.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -131.14 -27.08 2.06 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.378 0.671 . . . . 0.0 110.512 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.54 -36.86 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.05 -0.406 . . . . 0.0 110.261 177.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.13 -32.95 65.3 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -58.91 -45.25 90.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.283 0.633 . . . . 0.0 109.718 175.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -76.07 -25.92 55.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.895 -176.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -68.67 -42.54 77.74 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.534 0.607 . . . . 0.0 111.624 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 81.3 mmm -73.21 -33.52 65.42 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.488 0.585 . . . . 0.0 110.948 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -67.78 -38.92 84.01 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.495 177.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -66.86 -25.3 66.34 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.21 -36.92 71.57 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.3 mm -70.38 -41.02 78.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 117.794 0.797 . . . . 0.0 110.011 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -70.21 -34.03 72.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.643 -0.132 . . . . 0.0 110.643 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.35 -33.46 74.32 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.053 -0.404 . . . . 0.0 110.437 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.2 t -73.36 -30.63 63.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.14 -28.02 65.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.317 0.247 . . . . 0.0 111.024 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -89.43 -13.2 38.18 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.424 0.289 . . . . 0.0 110.934 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.84 2.03 47.44 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.011 0.525 . . . . 0.0 111.751 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -140.09 2.35 1.91 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.635 0.374 . . . . 0.0 111.275 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.05 85.68 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.944 -0.473 . . . . 0.0 113.228 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.16 -11.76 51.42 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 117.835 0.817 . . . . 0.0 111.668 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.09 135.7 12.48 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.416 0.686 . . . . 0.0 109.333 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -148.99 4.04 0.62 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.359 0.664 . . . . 0.0 111.368 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -158.43 -172.77 3.99 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.939 0.496 . . . . 0.0 110.159 -175.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.0 p -138.44 -177.27 4.78 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.536 0.734 . . . . 0.0 110.222 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . 0.63 ' HG2' ' H ' ' A' ' 78' ' ' SER . 33.7 tt0 -139.44 -170.03 2.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 122.862 0.465 . . . . 0.0 110.286 -174.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.63 ' H ' ' HG2' ' A' ' 77' ' ' GLN . 66.1 m -130.97 50.98 2.18 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.798 0.839 . . . . 0.0 110.311 -176.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -70.57 25.87 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.341 1.056 . . . . 0.0 112.225 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.452 ' H ' ' C ' ' A' ' 78' ' ' SER . . . -147.46 -178.78 6.43 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.944 1.298 . . . . 0.0 108.993 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.72 4.87 2.37 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -176.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.61 22.45 0.02 OUTLIER Glycine 0 CA--C 1.527 0.792 0 C-N-CA 120.27 -0.967 . . . . 0.0 114.279 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.4 t -146.93 -15.62 0.41 Allowed 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.668 1.234 . . . . 0.0 113.222 -177.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -141.22 -39.6 0.4 Allowed 'General case' 0 N--CA 1.461 0.104 0 O-C-N 121.694 -0.629 . . . . 0.0 109.729 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.11 -27.18 67.86 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 173.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.73 -24.71 36.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 122.815 0.446 . . . . 0.0 110.668 177.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.88 -0.74 57.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -177.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.62 -23.78 2.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.475 0.579 . . . . 0.0 111.757 174.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.31 -1.62 24.51 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.011 0.524 . . . . 0.0 111.298 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.432 ' C ' HD22 ' A' ' 91' ' ' LEU . 69.8 mtp180 -122.95 -11.59 8.09 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 122.972 0.509 . . . . 0.0 111.034 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.492 HD11 HD13 ' A' ' 137' ' ' ILE . 3.0 mm? -130.08 29.56 4.91 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.198 0.999 . . . . 0.0 110.325 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.97 10.39 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.655 1.182 . . . . 0.0 113.726 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.428 ' H ' ' C ' ' A' ' 91' ' ' LEU . 87.9 mmt-85 -130.08 0.18 4.69 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.413 0.685 . . . . 0.0 111.513 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.1 ttm -83.56 149.79 26.36 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.721 0.408 . . . . 0.0 110.432 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.1 m -63.52 138.97 97.51 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 123.722 0.809 . . . . 0.0 109.878 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.85 5.79 1.24 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.058 3.172 . . . . 0.0 113.364 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -121.3 -38.13 2.84 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.4 m -69.28 -24.23 63.93 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.835 -0.54 . . . . 0.0 109.955 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -70.73 -36.17 73.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.175 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -80.74 -24.1 38.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 118.613 0.642 . . . . 0.0 110.233 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.14 -33.91 76.47 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 173.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.5 tp -66.95 -41.17 87.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.6 mt -71.49 -5.09 30.5 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.527 0.331 . . . . 0.0 111.207 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 21.2 tp -111.81 -4.76 14.53 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.225 0.61 . . . . 0.0 112.216 -175.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -138.64 5.03 2.4 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -134.38 5.65 3.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.859 0.299 . . . . 0.0 111.518 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.3 mtm -136.91 2.43 2.6 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.637 0.775 . . . . 0.0 111.887 176.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -148.37 -19.64 0.33 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.566 0.621 . . . . 0.0 112.404 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 66.96 15.88 65.54 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-O 119.253 -0.749 . . . . 0.0 113.614 175.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -57.69 154.24 12.01 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.524 1.162 . . . . 0.0 111.453 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -63.31 146.35 96.27 Favored Pre-proline 0 N--CA 1.45 -0.448 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.554 175.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.37 -16.35 51.09 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 122.566 2.177 . . . . 0.0 111.364 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -73.99 -43.52 57.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.969 0.35 . . . . 0.0 110.268 178.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -78.09 -29.63 49.16 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.51 -28.82 67.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.913 -0.13 . . . . 0.0 110.812 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -74.32 -35.24 63.64 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -68.93 -26.26 64.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.659 0.384 . . . . 0.0 111.156 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -80.06 -9.07 59.67 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 18.4 pt -134.79 13.89 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 118.602 0.637 . . . . 0.0 111.371 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 58.97 53.07 5.84 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.683 1.193 . . . . 0.0 114.02 175.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.1 m -137.77 -175.69 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 C-N-CA 123.477 0.711 . . . . 0.0 110.057 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -91.88 162.31 14.48 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 175.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.1 m -58.62 -39.07 79.44 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 122.029 -0.419 . . . . 0.0 111.655 -177.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.8 p -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -74.58 -36.68 63.04 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 177.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.33 -38.05 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -61.79 -37.85 85.88 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.459 0.118 . . . . 0.0 111.001 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.5 m -75.45 -38.41 59.69 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 122.123 -0.36 . . . . 0.0 110.76 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -66.53 -31.97 73.03 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.389 -0.339 . . . . 0.0 111.727 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -82.19 -26.87 9.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 CA-C-N 118.689 0.677 . . . . 0.0 110.732 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 67.0 m -68.37 -35.85 78.33 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -78.22 -27.49 47.76 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.212 -0.305 . . . . 0.0 110.537 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.84 -42.52 70.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.278 -0.264 . . . . 0.0 110.666 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -75.58 -22.24 57.13 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.11 -0.369 . . . . 0.0 111.081 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.27 -36.64 69.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -73.72 -21.32 60.26 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 119.448 -0.311 . . . . 0.0 110.66 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.492 HD13 HD11 ' A' ' 91' ' ' LEU . 11.5 mm -74.14 -53.56 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.335 0.516 . . . . 0.0 109.665 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.95 -22.06 66.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.392 0.277 . . . . 0.0 111.634 -176.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -73.68 -24.89 60.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -157.64 -36.38 0.07 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -168.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 27.7 p . . . . . 0 N--CA 1.466 0.358 0 C-N-CA 124.798 1.239 . . . . 0.0 114.236 -171.884 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 120.442 0.163 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -63.88 -24.2 67.65 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.116 -0.365 . . . . 0.0 110.776 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -73.86 -34.06 56.68 Favored Glycine 0 C--N 1.337 0.612 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.03 -21.55 63.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.265 0.533 . . . . 0.0 110.743 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.45 -41.16 20.17 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.77 -42.11 58.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.448 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -66.28 -33.34 75.52 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.841 -178.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.0 t -66.02 -42.66 89.34 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.475 0.58 . . . . 0.0 109.832 178.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -18.77 65.27 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -107.87 -12.47 15.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.082 -0.386 . . . . 0.0 111.571 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -69.18 -35.87 76.74 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -70.59 -23.13 62.52 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 57.9 m -70.92 -12.22 61.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.959 0.504 . . . . 0.0 111.435 175.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 38.5 pt -131.54 11.64 1.81 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.804 0.442 . . . . 0.0 111.641 -177.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -80.13 21.98 0.55 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.236 0.614 . . . . 0.0 110.553 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -137.7 -179.04 5.51 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.163 0.585 . . . . 0.0 111.107 -174.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -61.63 -179.9 0.21 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.066 0.946 . . . . 0.0 112.094 178.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.77 155.03 81.92 Favored Pre-proline 0 CA--C 1.528 0.113 0 C-N-CA 122.887 0.475 . . . . 0.0 110.016 -177.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -74.73 176.3 9.99 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.102 2.535 . . . . 0.0 110.78 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -146.46 -0.78 0.74 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.466 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -62.38 -24.38 67.34 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.004 0.521 . . . . 0.0 111.569 -179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . 0.411 ' SD ' HG12 ' A' ' 32' ' ' VAL . 56.7 mtm -78.98 -37.11 40.2 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.577 0.351 . . . . 0.0 110.752 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -80.39 -17.02 53.09 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -69.02 -21.09 64.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.225 -0.297 . . . . 0.0 110.221 171.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -68.53 -20.56 64.57 Favored 'General case' 0 C--O 1.228 -0.052 0 O-C-N 122.024 -0.422 . . . . 0.0 110.03 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.432 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.6 mt -80.46 -21.38 42.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.214 173.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -75.18 10.92 1.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 172.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.432 ' H ' ' C ' ' B' ' 52' ' ' LEU . 37.6 ttpt -120.08 -1.27 10.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.822 1.249 . . . . 0.0 110.112 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -149.43 -13.91 0.29 Allowed 'General case' 0 C--N 1.34 0.184 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.279 0 C-N-CA 123.293 0.637 . . . . 0.0 111.908 179.684 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.7 p . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -63.64 -12.43 33.68 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.57 -27.97 61.88 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -75.3 1.0 14.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.699 0.8 . . . . 0.0 111.193 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -132.27 -1.85 3.57 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.591 0.756 . . . . 0.0 111.262 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.482 HD21 ' CZ ' ' A' ' 46' ' ' PHE . 44.7 mt -111.81 -31.53 6.92 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.585 0.354 . . . . 0.0 111.052 176.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.412 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -71.39 -44.41 13.07 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 83.6 Cg_endo -76.73 -3.86 14.28 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.253 1.969 . . . . 0.0 112.834 -175.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -135.47 14.58 3.45 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 122.949 0.5 . . . . 0.0 110.643 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 16.4 tp -56.0 -39.74 79.66 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -174.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.39 -4.47 13.7 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.083 1.855 . . . . 0.0 112.667 -178.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -65.51 -23.29 66.85 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.665 0.666 . . . . 0.0 111.733 -176.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mp -74.49 -18.8 60.57 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.561 -0.712 . . . . 0.0 110.309 176.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -99.58 -27.92 13.46 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.589 0.356 . . . . 0.0 111.168 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -61.39 -15.67 38.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -140.41 -16.8 0.92 Allowed 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 174.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.46 -26.34 74.3 Favored Glycine 0 C--N 1.338 0.661 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -66.45 -37.63 85.58 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.014 0.907 . . . . 0.0 110.497 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.76 -16.07 54.79 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.529 0.331 . . . . 0.0 111.332 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.4 tp -79.53 -2.21 41.2 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.897 0.479 . . . . 0.0 111.952 -177.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.8 t -147.86 -16.78 0.36 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.907 -0.496 . . . . 0.0 112.333 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.33 11.55 85.4 Favored Glycine 0 CA--C 1.527 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 113.138 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.9 m -142.8 123.26 13.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.141 0.97 . . . . 0.0 110.12 -178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -66.73 -24.1 66.19 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.762 -177.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -68.72 -39.13 80.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.1 0.409 . . . . 0.0 110.891 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -82.36 -31.79 29.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.74 -43.72 95.85 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.57 -33.67 73.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.428 0.614 . . . . 0.0 110.546 178.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.3 -45.63 75.96 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 122.543 0.337 . . . . 0.0 110.968 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -64.13 -34.41 77.99 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.035 0.38 . . . . 0.0 111.032 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.36 -55.07 26.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 117.812 0.278 . . . . 0.0 111.116 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.1 ttp180 -75.51 -27.12 58.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.01 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.02 -26.74 64.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 117.499 0.136 . . . . 0.0 110.758 176.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.8 m -65.87 -38.09 87.88 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.4 OUTLIER -73.7 -43.19 59.97 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -61.98 -18.57 60.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.848 0.459 . . . . 0.0 110.96 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -86.77 0.3 55.01 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.077 0.551 . . . . 0.0 112.078 177.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 77.6 mt -120.68 -20.9 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 122.724 0.41 . . . . 0.0 111.407 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.9 m -65.88 -4.5 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 118.832 0.742 . . . . 0.0 112.326 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.12 3.64 7.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.647 0.779 . . . . 0.0 110.31 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.0 56.29 1.26 Allowed Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.648 0.779 . . . . 0.0 110.303 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -64.99 -10.96 27.52 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.005 2.47 . . . . 0.0 111.782 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.26 -16.46 62.48 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.968 -0.457 . . . . 0.0 110.479 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -84.5 3.07 38.11 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.005 0.522 . . . . 0.0 110.909 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.482 ' CZ ' HD21 ' A' ' 7' ' ' LEU . 30.2 t80 -129.36 68.17 79.81 Favored Pre-proline 0 N--CA 1.454 -0.244 0 C-N-CA 122.408 0.283 . . . . 0.0 110.783 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.03 167.71 24.01 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.827 3.018 . . . . 0.0 110.746 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.2 11.28 11.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.82 7.55 3.05 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.072 0.949 . . . . 0.0 111.558 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 32.6 m -134.92 177.41 6.87 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.777 0.831 . . . . 0.0 109.911 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -59.32 151.23 59.99 Favored Pre-proline 0 N--CA 1.455 -0.22 0 C-N-CA 122.43 0.292 . . . . 0.0 110.291 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -70.64 12.71 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.063 3.176 . . . . 0.0 111.629 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -133.52 -17.61 2.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.438 0.695 . . . . 0.0 111.734 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 41.8 tp -74.45 -31.65 62.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.565 0.621 . . . . 0.0 110.198 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.91 -26.41 64.71 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -67.34 -42.17 83.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -79.87 -32.58 40.41 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.562 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -63.72 -44.81 92.51 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.632 0.651 . . . . 0.0 111.448 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.3 mmm -76.73 -33.4 58.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.01 -176.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -69.88 -33.31 72.07 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.477 177.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -67.53 -29.02 68.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.29 -37.98 71.19 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 49.5 mm -72.21 -38.25 61.71 Favored 'Isoleucine or valine' 0 C--O 1.23 0.074 0 CA-C-N 117.692 0.746 . . . . 0.0 110.267 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -69.52 -33.76 73.28 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.264 -0.272 . . . . 0.0 110.554 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.05 -33.11 73.06 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.106 -0.371 . . . . 0.0 110.262 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.2 t -73.06 -25.71 61.02 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.15 -36.5 61.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.169 0.187 . . . . 0.0 110.594 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -75.64 -23.86 56.38 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.3 -0.25 . . . . 0.0 110.452 176.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -72.6 2.14 6.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.262 0.625 . . . . 0.0 111.869 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -140.11 3.85 2.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.038 0.535 . . . . 0.0 111.001 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 72.19 13.95 76.57 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.82 -0.433 . . . . 0.0 112.524 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -69.14 -6.11 26.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 117.675 0.737 . . . . 0.0 111.454 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.28 159.83 43.2 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.062 -0.399 . . . . 0.0 110.69 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -148.69 -166.67 2.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.973 1.309 . . . . 0.0 108.76 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -57.63 173.23 0.3 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.116 0.566 . . . . 0.0 110.617 174.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.6 p -138.14 171.54 14.25 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.26 0.552 . . . . 0.0 111.996 -173.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -145.5 16.72 1.48 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.713 0.805 . . . . 0.0 110.67 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m 61.77 179.06 0.12 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.465 1.106 . . . . 0.0 112.642 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -141.39 25.78 2.02 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.882 0.473 . . . . 0.0 111.394 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.64 -173.63 2.79 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.714 0.806 . . . . 0.0 109.928 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.8 8.0 3.26 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -173.27 10.29 0.04 OUTLIER Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.643 -0.789 . . . . 0.0 114.446 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.6 t -148.38 9.09 0.83 Allowed 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.52 1.16 . . . . 0.0 112.269 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -154.02 -41.79 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.988 -0.445 . . . . 0.0 109.99 174.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.19 -23.09 64.8 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 121.65 -0.656 . . . . 0.0 109.808 174.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.43 -26.1 38.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 122.446 0.299 . . . . 0.0 110.364 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.64 -3.76 54.33 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.184 0.594 . . . . 0.0 111.845 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -129.75 -13.07 4.24 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.07 -1.92 31.47 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.098 0.559 . . . . 0.0 110.794 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.48 ' C ' HD22 ' A' ' 91' ' ' LEU . 86.6 mtt-85 -126.49 -15.62 5.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.489 0.716 . . . . 0.0 110.594 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.48 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.1 mm? -135.96 38.89 2.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.782 1.233 . . . . 0.0 110.204 -176.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.33 2.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -130.42 7.81 4.97 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.916 0.78 . . . . 0.0 112.333 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 tpp -61.86 142.78 57.16 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.014 0.37 . . . . 0.0 110.034 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 m -64.07 137.88 97.24 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.091 0.556 . . . . 0.0 109.665 178.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -68.81 5.5 1.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.905 3.07 . . . . 0.0 113.394 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -127.54 -33.67 2.3 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.5 m -67.84 -24.16 65.24 Favored 'General case' 0 C--N 1.337 0.057 0 O-C-N 121.858 -0.526 . . . . 0.0 109.951 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttm-85 -67.09 -32.52 73.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.671 0.388 . . . . 0.0 110.195 174.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -74.51 -37.48 63.09 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.34 -34.07 75.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 122.184 -0.322 . . . . 0.0 110.285 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.2 tp -65.96 -42.59 89.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.676 0.39 . . . . 0.0 110.947 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.13 -6.68 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.712 -0.617 . . . . 0.0 111.347 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -97.94 -4.9 35.45 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 175.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 69.4 p -134.84 3.37 3.22 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -140.16 10.43 2.35 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.246 0.475 . . . . 0.0 112.084 177.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.435 ' SD ' ' HB3' ' B' ' 32' ' ' LEU . 2.4 mtm -137.49 -8.9 1.69 Allowed 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -150.27 -9.01 0.28 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.012 0.824 . . . . 0.0 112.683 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 69.51 23.07 76.71 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.084 -0.842 . . . . 0.0 113.738 173.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -56.19 150.83 13.5 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.709 1.254 . . . . 0.0 109.98 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.4 m -66.07 155.61 86.75 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.3 -19.62 43.72 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 122.382 2.055 . . . . 0.0 111.357 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -73.57 -33.49 64.68 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.997 -0.439 . . . . 0.0 110.224 176.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -83.4 -37.91 22.65 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.31 0.244 . . . . 0.0 110.434 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.11 -27.4 68.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.213 -0.304 . . . . 0.0 111.03 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.16 -32.07 33.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 117.688 0.222 . . . . 0.0 110.721 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -71.4 -30.55 66.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.134 0.574 . . . . 0.0 110.836 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 58.6 mt -74.14 -5.77 43.72 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 176.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.0 pt -135.38 11.57 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 118.725 0.693 . . . . 0.0 111.289 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 55.06 54.55 8.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.516 1.126 . . . . 0.0 114.016 176.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.9 m -136.06 176.07 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.111 0.564 . . . . 0.0 110.266 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -74.38 157.3 35.93 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 88.4 m -60.97 -36.23 78.86 Favored 'General case' 0 N--CA 1.457 -0.106 0 O-C-N 122.193 -0.317 . . . . 0.0 110.81 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 95.6 p -75.94 -21.17 57.32 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.063 -0.398 . . . . 0.0 111.134 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -74.67 -43.29 55.98 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.087 -0.383 . . . . 0.0 110.413 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.63 -31.5 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 C-N-CA 119.481 -0.888 . . . . 0.0 110.063 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -63.67 -34.11 77.12 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.8 m -77.13 -37.59 53.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.222 -0.299 . . . . 0.0 110.422 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.03 -33.79 76.88 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.383 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.12 -26.86 9.21 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 118.314 0.506 . . . . 0.0 111.096 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.5 m -67.59 -38.5 84.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -78.34 -25.2 46.34 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 122.263 -0.273 . . . . 0.0 110.5 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.72 48.61 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.744 0.247 . . . . 0.0 110.342 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.79 -22.21 63.34 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.084 -0.385 . . . . 0.0 110.968 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.1 -36.41 69.45 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.387 -0.196 . . . . 0.0 110.967 176.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -83.79 -16.8 43.31 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.759 -0.588 . . . . 0.0 111.094 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 9.4 mm -62.24 -52.63 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.53 -17.31 60.76 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.88 -15.6 63.1 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -147.47 -44.4 0.17 Allowed 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 47.6 p . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 118.759 2.874 . . . . 0.0 118.759 -177.204 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 . . . . . 0 CA--C 1.53 0.173 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.6 tpt -63.08 -25.76 68.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.908 0.322 . . . . 0.0 111.46 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.02 58.72 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.71 -16.04 62.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.238 -0.566 . . . . 0.0 111.014 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.12 -39.24 18.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.435 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 63.2 mt -74.43 -38.07 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.937 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -68.26 -33.69 74.83 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.175 -0.44 . . . . 0.0 110.471 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.5 t -66.24 -36.5 83.17 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.665 0.666 . . . . 0.0 110.622 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.65 -32.09 73.47 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.584 0.231 . . . . 0.0 111.014 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -97.96 -11.38 23.14 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 68.7 tp60 -71.36 -36.68 71.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 121.899 -0.501 . . . . 0.0 110.196 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -64.63 -24.35 67.56 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 120.311 -0.555 . . . . 0.0 110.835 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 13.1 m -70.17 -12.62 61.73 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 111.382 0.141 . . . . 0.0 111.382 174.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 67.6 mt -107.16 -18.05 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 O-C-N 121.96 -0.463 . . . . 0.0 110.785 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.51 26.64 0.1 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.575 0.75 . . . . 0.0 112.054 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -142.06 176.5 8.91 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.058 0.543 . . . . 0.0 111.151 -178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -63.35 175.31 1.01 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.865 0.866 . . . . 0.0 111.362 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.94 155.12 80.51 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 122.407 0.283 . . . . 0.0 110.481 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . 0.451 ' C ' ' H ' ' B' ' 47' ' ' GLU . 51.5 Cg_exo -54.79 -39.55 89.15 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.681 2.921 . . . . 0.0 114.952 -174.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.8 t70 51.37 -11.18 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.473 1.909 . . . . 0.0 115.286 -174.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.451 ' H ' ' C ' ' B' ' 45' ' ' PRO . 14.1 pt-20 -66.53 -16.51 64.2 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.131 -0.981 . . . . 0.0 111.65 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 29.6 mtm -73.3 -32.25 64.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.274 -0.266 . . . . 0.0 111.044 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -84.24 -12.27 55.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.793 -0.567 . . . . 0.0 110.018 173.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.21 -20.61 62.24 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.837 -0.539 . . . . 0.0 109.649 169.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 75.9 mt -78.55 -13.58 59.76 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.337 0.255 . . . . 0.0 110.406 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -88.13 -16.0 34.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -75.55 6.85 4.22 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.845 0.858 . . . . 0.0 111.675 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -127.66 9.77 6.53 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.732 0.813 . . . . 0.0 111.566 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 pp -145.21 -17.33 0.49 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 120.807 0.337 . . . . 0.0 110.78 173.631 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.9 t . . . . . 0 N--CA 1.456 -0.142 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.3 tp -59.22 -28.57 66.8 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.038 0.535 . . . . 0.0 110.967 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.45 -31.5 80.97 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.938 -0.465 . . . . 0.0 111.938 -178.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -77.17 1.42 18.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 122.719 0.408 . . . . 0.0 111.265 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -133.07 3.57 3.71 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.189 0.595 . . . . 0.0 110.695 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.6 tp -111.69 -41.1 4.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.542 0.337 . . . . 0.0 110.45 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.415 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.16 -45.23 99.88 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 98.9 Cg_endo -74.86 -0.39 9.84 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.431 2.087 . . . . 0.0 112.774 -176.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -135.13 14.04 3.55 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 68.3 mt -54.33 -44.31 98.57 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.574 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -81.47 -10.01 12.25 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.07 1.847 . . . . 0.0 112.672 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.57 -24.52 66.36 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 118.646 0.657 . . . . 0.0 110.621 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.2 mt -67.4 -18.92 65.31 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.67 0.271 . . . . 0.0 110.442 176.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -98.81 -14.65 19.58 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.462 0.705 . . . . 0.0 110.276 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -16.24 53.78 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.438 0.695 . . . . 0.0 111.097 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -141.59 -21.02 0.74 Allowed 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.52 -23.24 77.76 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -71.87 -10.02 59.16 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 117.657 0.729 . . . . 0.0 111.647 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.08 6.1 5.39 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.74 0.416 . . . . 0.0 111.466 -177.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -91.95 -0.96 57.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.098 0.559 . . . . 0.0 110.437 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 t -151.37 -4.95 0.28 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.44 18.08 71.28 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.44 -0.788 . . . . 0.0 114.096 173.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 t -143.81 131.24 21.0 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 118.344 1.072 . . . . 0.0 110.16 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -74.67 -22.94 58.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.181 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.57 -35.53 58.13 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -73.88 -35.77 64.74 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.0 -36.57 86.38 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.64 -35.69 75.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.222 0.511 . . . . 0.0 111.323 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.8 24.07 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.753 -176.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -65.18 -35.98 82.79 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.295 0.952 . . . . 0.0 109.427 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 24.6 t -62.91 -53.52 45.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 C-N-CA 122.338 0.255 . . . . 0.0 110.687 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -71.58 -28.12 63.61 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.43 -175.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.02 -21.59 59.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 122.201 0.2 . . . . 0.0 110.748 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 m -66.37 -44.88 81.92 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -38.1 64.2 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.964 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -67.32 -14.56 63.03 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.803 -0.561 . . . . 0.0 110.923 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.4 0.4 56.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.324 0.65 . . . . 0.0 111.216 174.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 88.3 mt -123.57 -14.27 5.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 123.523 0.729 . . . . 0.0 111.358 -174.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -60.07 -4.79 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 121.503 -0.748 . . . . 0.0 112.964 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.3 2.1 8.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.024 0.53 . . . . 0.0 111.143 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.32 54.74 0.86 Allowed Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 123.651 0.781 . . . . 0.0 110.544 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.7 -13.04 36.83 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 123.435 2.757 . . . . 0.0 113.049 -174.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -74.99 -14.97 60.68 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.463 0.305 . . . . 0.0 111.213 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -77.74 -19.79 54.56 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.007 -0.433 . . . . 0.0 111.016 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.46 114.55 52.33 Favored Pre-proline 0 N--CA 1.452 -0.345 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.87 155.09 71.12 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.526 2.151 . . . . 0.0 110.986 -176.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -136.8 12.85 3.15 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.771 0.828 . . . . 0.0 110.772 -174.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -134.73 27.93 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.343 0.657 . . . . 0.0 111.041 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.6 m -134.76 179.15 4.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 123.828 0.851 . . . . 0.0 109.207 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -54.43 146.72 31.79 Favored Pre-proline 0 CA--C 1.531 0.212 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -70.79 9.71 0.73 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.826 3.017 . . . . 0.0 111.722 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -129.37 -16.88 3.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.5 0.72 . . . . 0.0 110.933 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.8 tp -78.84 -34.17 45.37 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.165 0.439 . . . . 0.0 110.303 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.64 -31.28 60.79 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.54 -47.67 77.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -74.75 -30.0 61.34 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 119.698 -0.191 . . . . 0.0 111.485 -177.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -63.05 -45.91 89.99 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 118.382 0.537 . . . . 0.0 110.605 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 92.9 mmm -73.54 -31.3 63.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.829 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.37 -37.9 74.65 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.036 0.38 . . . . 0.0 111.016 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -65.71 -24.82 67.07 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.29 -37.22 63.24 Favored Glycine 0 C--N 1.339 0.721 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.5 mm -73.19 -39.93 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 CA-C-N 117.709 0.755 . . . . 0.0 110.432 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -68.27 -33.64 74.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.293 -0.254 . . . . 0.0 111.122 -177.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.32 -31.54 68.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 117.78 0.264 . . . . 0.0 110.433 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.2 t -75.97 -26.1 56.46 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.146 0.178 . . . . 0.0 110.835 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.58 -36.79 68.26 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.382 0.273 . . . . 0.0 110.991 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -77.15 -22.81 52.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.55 3.64 18.21 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.259 0.624 . . . . 0.0 111.747 177.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -138.86 2.91 2.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.846 0.458 . . . . 0.0 111.242 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.43 26.62 72.95 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 119.684 -0.509 . . . . 0.0 113.133 175.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.63 -10.15 17.3 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.164 0.982 . . . . 0.0 112.249 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.65 158.5 38.42 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.057 0.543 . . . . 0.0 110.363 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -144.52 5.73 1.23 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.344 0.657 . . . . 0.0 110.769 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.0 t -156.69 178.09 10.73 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.071 0.548 . . . . 0.0 109.956 -177.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.5 p -145.43 17.24 1.51 Allowed 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.528 0.731 . . . . 0.0 110.619 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -56.42 150.32 15.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.11 0.564 . . . . 0.0 110.278 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -144.84 -176.27 5.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.22 0.608 . . . . 0.0 109.855 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -141.21 13.12 2.2 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.782 0.433 . . . . 0.0 111.697 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.82 156.92 13.2 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.062 -0.398 . . . . 0.0 110.835 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.42 -11.94 59.91 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -175.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 156.19 26.04 0.03 OUTLIER Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.305 -0.719 . . . . 0.0 113.787 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.7 t -138.05 13.48 2.86 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.602 1.201 . . . . 0.0 112.111 -177.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -155.16 -50.04 0.09 Allowed 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -20.75 64.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.477 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.56 -29.96 47.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 122.465 0.306 . . . . 0.0 110.828 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.23 -2.05 54.63 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.822 0.449 . . . . 0.0 111.564 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -116.04 -44.62 2.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.58 0.352 . . . . 0.0 110.776 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.7 -1.61 1.99 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.468 ' C ' HD22 ' A' ' 91' ' ' LEU . 82.6 mtt-85 -120.82 -15.38 8.36 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.424 0.69 . . . . 0.0 111.516 178.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.468 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.1 mm? -134.32 28.23 3.73 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.909 0.884 . . . . 0.0 110.626 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.88 1.07 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -130.85 0.29 4.29 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.641 0.655 . . . . 0.0 112.097 -175.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.7 ttm -59.14 152.02 21.35 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.6 m -53.46 137.76 50.69 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 123.172 0.589 . . . . 0.0 110.548 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.95 -5.43 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 125.083 3.855 . . . . 0.0 115.9 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 21.7 tp -133.57 -23.49 1.84 Allowed 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 111.898 -178.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 48.2 m -68.74 -24.7 64.49 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.639 0.654 . . . . 0.0 109.878 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 69.3 ttt-85 -73.07 -27.78 61.93 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -78.27 -35.24 48.35 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.84 74.59 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.3 tp -65.76 -49.78 67.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.395 0.278 . . . . 0.0 110.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.26 -4.55 33.81 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 115' ' ' ALA . 19.1 tp -106.15 -4.59 20.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.09 0.556 . . . . 0.0 111.72 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 77.3 p -140.06 3.28 1.98 Allowed 'General case' 0 C--N 1.34 0.189 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.52 6.2 4.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.324 0.511 . . . . 0.0 112.147 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 1.4 mtm -127.38 -7.7 5.81 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.927 0.491 . . . . 0.0 111.887 176.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -150.65 -22.9 0.23 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.744 0.702 . . . . 0.0 112.103 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 79.05 28.05 54.87 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.218 -0.768 . . . . 0.0 113.426 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -51.25 149.22 4.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.275 1.037 . . . . 0.0 110.659 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.0 m -62.16 152.54 77.99 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.78 -17.02 37.73 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.996 2.464 . . . . 0.0 111.945 -176.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -78.98 -41.34 29.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.029 0.377 . . . . 0.0 110.368 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -78.7 -30.51 46.05 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.425 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -68.49 -25.36 64.93 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 175.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.05 -27.75 35.61 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.125 0.17 . . . . 0.0 110.757 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -70.45 -33.42 71.27 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.036 0.535 . . . . 0.0 111.628 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 77.7 mt -74.02 -4.29 34.46 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.411 HG13 HG22 ' A' ' 121' ' ' VAL . 28.6 pt -135.92 9.22 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 118.306 0.503 . . . . 0.0 110.978 177.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 50.08 61.04 3.39 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.136 1.374 . . . . 0.0 113.935 178.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 119' ' ' ILE . 22.3 m -134.69 -175.51 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 C-N-CA 123.854 0.862 . . . . 0.0 109.792 175.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -89.65 159.66 17.02 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -56.51 -39.11 72.75 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 122.565 0.346 . . . . 0.0 111.416 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.2 m -70.82 -20.57 62.55 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.868 0.467 . . . . 0.0 112.034 -177.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -73.98 -40.7 62.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.5 t -63.45 -38.22 81.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.12 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -60.56 -38.44 84.55 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.48 0.181 . . . . 0.0 110.856 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.3 m -76.12 -37.71 57.75 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.905 -0.134 . . . . 0.0 110.772 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.82 -34.09 77.04 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.415 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 m -81.34 -28.44 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 CA-C-N 118.452 0.569 . . . . 0.0 111.028 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 55.4 m -66.22 -40.52 90.36 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.49 -28.16 56.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.4 -44.11 65.56 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.344 -0.222 . . . . 0.0 111.246 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.61 -22.83 59.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 O-C-N 122.15 -0.344 . . . . 0.0 111.026 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.17 -42.63 72.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.611 0.187 . . . . 0.0 110.935 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -77.75 -17.8 57.17 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.151 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.5 mm -73.94 -53.93 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 173.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.43 -17.12 63.62 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -173.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -85.69 -10.84 55.06 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -156.69 -36.35 0.08 Allowed 'General case' 0 C--N 1.339 0.145 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -176.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 43.0 p . . . . . 0 N--CA 1.468 0.463 0 C-N-CA 124.341 1.056 . . . . 0.0 112.852 -169.728 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 111.013 0.005 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.61 -26.91 62.23 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.098 0.559 . . . . 0.0 112.269 -175.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.93 -42.52 96.84 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.32 -20.44 62.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 122.507 -0.408 . . . . 0.0 110.772 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.59 -36.53 70.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.74 -37.43 67.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -66.48 -32.63 74.11 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.563 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 57.8 m -66.6 -42.11 87.44 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.651 0.659 . . . . 0.0 110.74 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -24.5 64.95 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -107.73 -13.63 14.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -175.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -68.66 -31.26 70.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 170.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -57.5 -37.07 72.37 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 175.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.4 m -68.41 -12.58 61.36 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 46.6 mm -105.9 -16.02 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.803 -0.561 . . . . 0.0 111.259 -178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.92 28.62 0.17 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.252 0.621 . . . . 0.0 110.646 175.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -134.32 173.66 11.38 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.225 0.61 . . . . 0.0 111.309 -174.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -69.12 179.01 2.05 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.023 0.929 . . . . 0.0 110.89 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.4 m -136.82 155.01 76.73 Favored Pre-proline 0 C--O 1.233 0.234 0 C-N-CA 123.376 0.67 . . . . 0.0 110.41 -178.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -77.25 178.74 7.26 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.691 2.927 . . . . 0.0 110.531 176.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -145.99 -0.44 0.8 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.985 0.514 . . . . 0.0 110.929 175.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.15 -24.64 67.46 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 122.912 0.485 . . . . 0.0 112.242 -177.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 53.4 mtm -74.81 -32.78 62.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 122.225 -0.297 . . . . 0.0 110.788 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.71 -12.65 55.56 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.28 -20.44 61.51 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 69.9 mt -71.0 -18.35 62.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.181 -0.324 . . . . 0.0 110.337 172.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 18.5 mt -84.94 -19.15 32.63 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.728 173.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -73.14 8.19 1.76 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.932 0.333 . . . . 0.0 111.039 176.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -130.37 12.96 5.54 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.813 0.845 . . . . 0.0 109.986 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.1 mt -131.47 -26.36 2.06 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 123.568 0.747 . . . . 0.0 111.784 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.274 0 CA-C-N 118.016 0.371 . . . . 0.0 110.511 171.17 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.8 p . . . . . 0 CA--C 1.531 0.213 0 CA-C-O 120.805 0.336 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.2 tp -56.72 -33.36 66.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.669 0.788 . . . . 0.0 111.901 -178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.61 -35.08 91.5 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 121.69 -0.631 . . . . 0.0 112.051 -176.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -74.33 3.17 7.77 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.747 0.819 . . . . 0.0 110.94 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.3 mm-40 -131.81 -1.93 3.74 Favored 'General case' 0 N--CA 1.458 -0.059 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 tt -111.37 -43.05 3.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.125 0.57 . . . . 0.0 110.624 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.42 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -54.57 -45.2 99.53 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -175.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 83.9 Cg_endo -75.04 2.26 6.85 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.264 1.976 . . . . 0.0 113.16 -176.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -130.85 9.92 5.0 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.777 0.431 . . . . 0.0 112.02 -177.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -56.6 -42.35 95.83 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.81 -7.53 14.48 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.922 1.748 . . . . 0.0 112.58 -173.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -71.61 -19.86 62.06 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.542 0.61 . . . . 0.0 111.945 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.402 HD12 ' N ' ' A' ' 14' ' ' LEU . 8.8 mp -77.18 -23.36 51.54 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.815 -0.553 . . . . 0.0 110.886 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -101.78 -15.56 16.9 Favored 'General case' 0 C--O 1.228 -0.027 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -52.48 -27.66 17.15 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.711 1.205 . . . . 0.0 110.884 175.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -137.42 -13.54 1.54 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.568 0.347 . . . . 0.0 111.241 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.44 -34.95 87.51 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 47.2 tpt85 -65.44 -20.88 66.55 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.1 0.95 . . . . 0.0 111.369 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.92 -3.6 55.76 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.824 0.45 . . . . 0.0 110.906 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mp -111.56 7.77 20.72 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.956 0.902 . . . . 0.0 111.141 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.1 p -140.46 -22.43 0.82 Allowed 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.43 8.73 60.04 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-O 119.558 -0.579 . . . . 0.0 112.673 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.5 t -154.51 138.12 16.04 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.331 1.065 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -72.5 -23.19 60.99 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.438 -0.164 . . . . 0.0 110.821 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -70.33 -39.06 74.96 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.314 -0.241 . . . . 0.0 110.562 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -82.2 -32.07 30.04 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.07 -43.55 90.27 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -72.5 -29.4 63.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 117.341 0.57 . . . . 0.0 110.817 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 tmmm? -70.7 -44.04 67.77 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.882 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -64.67 -31.9 73.33 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.129 0.422 . . . . 0.0 110.91 179.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.4 t -62.08 -52.75 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 117.995 0.361 . . . . 0.0 110.935 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -76.59 -26.77 55.38 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.358 -176.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.38 -24.98 61.34 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.284 0.234 . . . . 0.0 110.503 176.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 66.3 m -65.98 -40.15 90.96 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 175.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 -46.64 65.6 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -59.62 -25.32 64.56 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.902 0.481 . . . . 0.0 111.695 -178.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.88 1.0 32.69 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.132 0.573 . . . . 0.0 111.617 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.4 mt -123.8 -16.01 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 123.766 0.826 . . . . 0.0 110.561 -176.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.5 t -59.59 -13.92 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.181 0.592 . . . . 0.0 111.641 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 3.74 9.67 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.063 0.545 . . . . 0.0 111.298 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.31 55.73 1.23 Allowed Pre-proline 0 N--CA 1.452 -0.346 0 C-N-CA 122.935 0.494 . . . . 0.0 110.608 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.45 -8.84 20.21 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.109 2.54 . . . . 0.0 112.173 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -78.7 -6.66 56.38 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.903 0.481 . . . . 0.0 110.791 174.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -99.49 8.51 44.46 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.511 0.725 . . . . 0.0 110.774 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.415 ' N ' ' HD3' ' A' ' 47' ' ' PRO . 6.3 t80 -134.23 62.06 53.98 Favored Pre-proline 0 CA--C 1.533 0.317 0 C-N-CA 123.064 0.546 . . . . 0.0 109.976 -178.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.415 ' HD3' ' N ' ' A' ' 46' ' ' PHE . 54.4 Cg_exo -52.78 163.69 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.701 3.601 . . . . 0.0 114.849 -175.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.401 ' HD3' ' C ' ' A' ' 47' ' ' PRO . 0.5 OUTLIER -121.41 8.99 10.24 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.49 1.116 . . . . 0.0 109.506 177.287 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -76.08 5.25 6.98 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.168 0.987 . . . . 0.0 111.891 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.3 m -136.68 -179.2 2.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.991 0.916 . . . . 0.0 109.347 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.485 ' C ' ' H ' ' A' ' 53' ' ' ARG . 1.8 m-20 -54.46 147.03 30.69 Favored Pre-proline 0 N--CA 1.455 -0.219 0 O-C-N 122.388 -0.195 . . . . 0.0 110.546 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -71.44 18.54 0.27 Allowed 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 124.148 3.232 . . . . 0.0 110.528 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 51' ' ' ASP . 86.6 mtm180 -131.51 -30.38 1.68 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.001 0.92 . . . . 0.0 110.99 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 62.1 tp -72.01 -39.42 69.22 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.682 0.219 . . . . 0.0 110.588 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.68 -29.83 62.84 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.68 -40.9 97.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.63 0.372 . . . . 0.0 110.075 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.54 -27.67 41.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -68.56 -41.45 79.73 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.358 -0.214 . . . . 0.0 110.838 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 98.4 mmm -81.71 -31.24 32.2 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.796 -0.145 . . . . 0.0 110.888 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.4 -37.39 83.04 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -71.87 -24.26 61.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.54 -37.69 93.94 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.8 mm -73.78 -35.47 43.49 Favored 'Isoleucine or valine' 0 C--N 1.338 0.104 0 CA-C-N 117.892 0.846 . . . . 0.0 109.882 176.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -65.9 -37.41 86.03 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.92 -30.27 67.64 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.305 -0.247 . . . . 0.0 110.832 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.3 t -74.89 -28.83 60.79 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 110.618 -0.141 . . . . 0.0 110.618 178.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.54 -31.11 65.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.097 -0.377 . . . . 0.0 110.709 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -83.01 -12.55 57.16 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.539 0.336 . . . . 0.0 110.705 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.9 5.84 49.91 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.351 0.66 . . . . 0.0 111.124 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -137.53 0.48 2.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.005 0.522 . . . . 0.0 111.133 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.67 6.21 89.11 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.732 -0.482 . . . . 0.0 113.323 176.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -66.49 -20.0 65.93 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.985 0.892 . . . . 0.0 110.621 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.99 153.11 29.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.818 0.847 . . . . 0.0 109.688 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -147.61 -0.59 0.64 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.735 0.414 . . . . 0.0 111.958 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.5 t -160.61 175.47 12.64 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.155 0.434 . . . . 0.0 110.436 -177.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.4 p -153.0 159.82 42.95 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.489 0.715 . . . . 0.0 110.121 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -160.91 177.03 10.78 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.277 0.631 . . . . 0.0 109.482 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.0 m -141.64 155.43 45.71 Favored 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 123.296 0.638 . . . . 0.0 109.314 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -152.09 14.04 0.61 Allowed 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -173.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.56 165.97 2.66 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.057 0.456 . . . . 0.0 111.223 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.37 -10.88 55.46 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.52 21.23 0.03 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.949 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.7 t -137.11 6.44 2.85 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.715 1.257 . . . . 0.0 112.742 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -143.92 -36.01 0.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.02 -25.63 66.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.6 -24.56 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 122.567 0.347 . . . . 0.0 110.517 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.06 -1.4 56.79 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.859 0.463 . . . . 0.0 111.814 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -130.41 -16.07 3.53 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 117.804 0.275 . . . . 0.0 111.625 175.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.07 -1.54 32.89 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.771 0.259 . . . . 0.0 110.566 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -130.55 -8.54 4.11 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.585 0.754 . . . . 0.0 112.034 -177.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.8 mt -139.58 12.9 2.53 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -170.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.54 5.45 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -130.29 3.73 4.73 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 119.12 0.873 . . . . 0.0 112.642 -173.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 52.9 ttm -67.09 158.99 29.77 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 98.0 m -59.01 138.08 87.71 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 122.89 0.476 . . . . 0.0 109.944 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 75.5 Cg_exo -52.0 -7.87 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 125.19 3.927 . . . . 0.0 116.335 -178.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.1 tp -131.73 -22.29 2.4 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 119.002 0.819 . . . . 0.0 111.814 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.4 m -66.99 -19.18 65.67 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.929 -0.482 . . . . 0.0 110.059 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -65.87 -34.13 77.43 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.649 0.38 . . . . 0.0 110.25 175.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -80.7 -34.69 34.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.27 -32.38 74.01 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.966 -0.459 . . . . 0.0 109.794 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.71 -46.14 73.08 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.004 0.522 . . . . 0.0 110.78 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -74.94 -6.65 50.37 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.353 0.524 . . . . 0.0 111.445 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 74.9 mt -99.79 -6.29 27.19 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.767 0.427 . . . . 0.0 112.0 176.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -135.08 4.72 3.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.488 0.585 . . . . 0.0 112.551 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.96 7.93 1.86 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.49 0.316 . . . . 0.0 111.383 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.404 ' SD ' ' HB3' ' B' ' 32' ' ' LEU . 3.1 mtm -141.98 1.83 1.49 Allowed 'General case' 0 C--N 1.338 0.087 0 C-N-CA 123.487 0.715 . . . . 0.0 111.87 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -149.43 -17.93 0.28 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.628 0.649 . . . . 0.0 112.187 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 72.51 10.85 76.15 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 119.282 -0.732 . . . . 0.0 113.401 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -59.73 148.21 35.02 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.819 1.309 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.2 m -70.06 152.51 95.8 Favored Pre-proline 0 N--CA 1.452 -0.333 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.29 -24.08 25.75 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.208 2.605 . . . . 0.0 113.206 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.05 -34.6 66.39 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.611 0.364 . . . . 0.0 111.343 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -79.68 -38.28 33.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.87 -24.68 65.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.729 -0.177 . . . . 0.0 111.124 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.4 -39.11 65.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.958 0.345 . . . . 0.0 110.507 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -67.38 -26.11 66.3 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.597 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 18.4 tp -83.47 -6.2 59.39 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -176.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.411 HG13 HG22 ' A' ' 121' ' ' VAL . 15.7 pt -135.46 11.99 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.645 0.657 . . . . 0.0 111.435 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 56.81 53.71 7.95 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.186 0.994 . . . . 0.0 113.524 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 119' ' ' ILE . 28.2 m -136.38 178.61 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 123.443 0.697 . . . . 0.0 110.058 176.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -80.44 157.67 26.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 46.5 m -60.35 -34.4 73.79 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.9 -0.5 . . . . 0.0 110.818 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 84.0 p -72.28 -21.36 61.37 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 122.377 -0.202 . . . . 0.0 111.46 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -74.39 -36.36 63.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.2 t -64.05 -37.69 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.71 -33.23 73.65 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.2 m -77.31 -38.28 50.89 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 122.341 -0.224 . . . . 0.0 110.795 177.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.2 -35.61 80.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.128 0.422 . . . . 0.0 111.429 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.5 m -76.42 -27.65 17.54 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 118.805 0.73 . . . . 0.0 110.716 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.3 m -67.43 -35.76 79.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -81.15 -25.06 37.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.77 -47.34 66.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.51 -22.43 61.79 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.818 -0.135 . . . . 0.0 110.966 179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.51 -36.7 68.42 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -72.85 -25.11 60.99 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 117.668 0.213 . . . . 0.0 110.605 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 20.2 mm -72.83 -54.62 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -61.54 -21.68 64.48 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.614 0.366 . . . . 0.0 111.685 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -72.23 -24.58 61.41 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -177.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -154.46 -53.52 0.1 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -169.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 22.7 p . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -171.309 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 . . . . . 0 CA--C 1.532 0.265 0 N-CA-C 111.44 0.163 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.6 tpt -55.03 -26.76 39.49 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.925 0.49 . . . . 0.0 112.166 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.25 -40.62 60.8 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.74 -20.3 62.65 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.565 -0.374 . . . . 0.0 110.514 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.4 -37.36 63.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.404 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 42.0 mt -77.5 -40.13 43.92 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.521 0.328 . . . . 0.0 110.302 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.46 -34.35 77.73 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.203 -0.311 . . . . 0.0 110.747 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 44.2 t -71.59 -37.36 70.99 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.092 0.405 . . . . 0.0 110.851 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.43 -23.87 65.58 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.247 0.219 . . . . 0.0 110.968 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -104.81 -11.75 16.63 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.146 -0.346 . . . . 0.0 111.289 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.0 -36.27 82.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -62.32 -35.76 80.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.654 0.381 . . . . 0.0 110.816 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 56.3 m -66.41 -11.82 53.72 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.548 0.574 . . . . 0.0 112.548 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 35.3 pt -129.4 13.16 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.926 -0.484 . . . . 0.0 111.545 -176.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.72 23.53 0.13 Allowed 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.599 0.76 . . . . 0.0 112.188 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.08 -178.53 5.75 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.753 -0.592 . . . . 0.0 111.826 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -63.74 -177.62 0.25 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.386 1.074 . . . . 0.0 112.503 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -134.3 156.62 78.81 Favored Pre-proline 0 CA--C 1.53 0.175 0 C-N-CA 123.466 0.707 . . . . 0.0 110.276 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.7 178.97 6.7 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 123.1 2.533 . . . . 0.0 110.622 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -146.47 -0.43 0.75 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.291 0.236 . . . . 0.0 111.456 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -63.01 -24.53 67.96 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.165 -0.334 . . . . 0.0 111.709 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.1 mtm -72.85 -29.8 63.49 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.217 0.207 . . . . 0.0 111.328 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.5 -14.37 43.28 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.1 -20.48 61.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.33 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.499 ' C ' ' H ' ' B' ' 54' ' ' LYS . 22.1 mt -76.69 -15.42 59.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 119.679 -0.201 . . . . 0.0 111.099 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -69.02 16.7 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.331 0.514 . . . . 0.0 111.13 173.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.499 ' H ' ' C ' ' B' ' 52' ' ' LEU . 53.7 mtmt -117.2 -3.77 11.47 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.456 1.102 . . . . 0.0 111.219 176.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -157.58 0.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.212 0 C-N-CA 123.281 0.632 . . . . 0.0 111.529 -179.385 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.5 m . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 42.3 tp -62.54 -27.27 69.05 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.111 -0.368 . . . . 0.0 110.687 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.46 -18.93 79.97 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-O 119.685 -0.508 . . . . 0.0 112.333 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -74.61 -2.31 25.44 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 117.984 0.892 . . . . 0.0 111.636 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -134.31 -21.37 1.82 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.18 0.592 . . . . 0.0 111.233 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.4 tp -75.59 -37.44 59.84 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.151 -0.343 . . . . 0.0 110.879 175.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.417 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -56.18 -46.75 99.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -173.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 87.7 Cg_endo -73.0 -3.47 13.69 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.523 2.149 . . . . 0.0 112.968 -177.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -129.22 11.11 5.89 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.311 0.505 . . . . 0.0 111.932 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.62 -46.26 99.85 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.21 -9.58 12.67 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 121.995 1.796 . . . . 0.0 112.427 -171.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.5 -32.52 73.45 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.505 0.593 . . . . 0.0 110.651 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.3 -18.22 61.81 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 122.368 -0.207 . . . . 0.0 111.047 -177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.6 mtm180 -98.88 -20.52 16.78 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.029 0.377 . . . . 0.0 110.773 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -61.42 -22.38 64.95 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 117.781 0.264 . . . . 0.0 110.74 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -130.34 -13.74 3.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.768 0.427 . . . . 0.0 110.876 175.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.19 73.82 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -68.17 -19.83 64.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 117.642 0.721 . . . . 0.0 111.052 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -100.93 4.3 42.47 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.623 0.769 . . . . 0.0 112.28 -175.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 59.9 mt -110.23 5.89 22.16 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.4 t -154.18 -20.43 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.964 0.802 . . . . 0.0 113.133 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.64 2.95 53.03 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 118.892 0.769 . . . . 0.0 114.225 174.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -154.82 146.31 23.11 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.658 1.229 . . . . 0.0 111.235 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -77.64 -17.92 57.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.926 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -70.92 -31.02 67.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -82.73 -32.57 27.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.798 0.439 . . . . 0.0 110.398 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.23 -39.94 81.99 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.33 -28.39 61.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.321 0.561 . . . . 0.0 110.4 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -69.26 -42.85 75.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.63 -42.14 95.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.217 -0.42 . . . . 0.0 111.656 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.7 m -67.64 -39.78 82.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.13 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -77.15 -29.26 54.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.515 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.03 -27.12 61.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.1 m -65.64 -40.48 92.56 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -40.92 26.26 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 121.082 -0.247 . . . . 0.0 111.068 -175.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -65.19 -24.65 67.43 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.221 -178.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.54 -1.16 23.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.267 0.627 . . . . 0.0 111.516 175.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 82.0 mt -118.14 -15.72 8.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.006 0.922 . . . . 0.0 109.763 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.18 -9.88 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.388 0.675 . . . . 0.0 111.333 175.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.2 -0.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.393 0.677 . . . . 0.0 110.898 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.21 57.51 1.49 Allowed Pre-proline 0 N--CA 1.452 -0.364 0 C-N-CA 123.29 0.636 . . . . 0.0 110.941 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -65.12 -11.0 27.85 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.086 2.524 . . . . 0.0 112.237 -177.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.17 -17.63 62.53 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.575 0.35 . . . . 0.0 110.653 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -83.3 0.8 44.13 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.999 0.52 . . . . 0.0 111.197 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -132.61 69.34 79.64 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.63 177.93 5.0 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 125.014 3.809 . . . . 0.0 112.197 -173.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 43.0 mmm-85 -123.56 7.09 8.89 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.727 0.811 . . . . 0.0 109.999 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -78.67 10.56 3.15 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.375 1.07 . . . . 0.0 111.844 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.47 171.85 16.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 C-N-CA 123.64 0.776 . . . . 0.0 109.843 -179.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.96 152.01 52.35 Favored Pre-proline 0 N--CA 1.453 -0.28 0 C-N-CA 122.605 0.362 . . . . 0.0 110.495 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -71.38 12.94 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.171 3.248 . . . . 0.0 111.749 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 28.5 mtp180 -131.6 -25.43 2.13 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.321 0.649 . . . . 0.0 110.856 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.3 tp -74.73 -35.94 62.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.38 -28.24 64.17 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.47 -46.01 88.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.14 0.576 . . . . 0.0 110.144 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -80.15 -27.01 39.12 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -65.31 -43.88 89.67 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 118.101 0.41 . . . . 0.0 111.179 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.9 mmm -74.4 -32.76 62.81 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.363 -178.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.6 -36.49 78.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.264 -0.273 . . . . 0.0 110.486 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.89 -26.17 66.75 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.782 0.433 . . . . 0.0 110.133 177.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.42 -39.89 69.18 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -74.19 -34.52 37.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.075 0 CA-C-N 117.794 0.797 . . . . 0.0 110.238 177.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -66.25 -33.02 74.8 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.438 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.41 -33.03 69.09 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 122.146 -0.347 . . . . 0.0 110.454 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -70.83 -25.92 63.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.5 -34.11 47.65 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.193 0.197 . . . . 0.0 110.717 177.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -71.94 -24.32 61.6 Favored 'General case' 0 C--N 1.34 0.178 0 O-C-N 122.14 -0.35 . . . . 0.0 110.336 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.22 0.58 18.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.194 0.598 . . . . 0.0 111.584 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -133.55 -1.03 3.16 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.092 0.557 . . . . 0.0 111.457 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.07 -4.72 83.16 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 122.145 -0.347 . . . . 0.0 112.957 177.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -74.07 -6.3 46.71 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -175.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.37 22.99 1.17 Allowed 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -78.83 4.2 14.67 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.123 -0.361 . . . . 0.0 111.214 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 8.9 t -152.46 168.11 26.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.774 0.83 . . . . 0.0 109.411 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.5 t -156.02 169.94 23.31 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 110.844 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -158.55 167.62 29.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.392 1.077 . . . . 0.0 108.821 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -69.55 170.07 11.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.276 0.56 . . . . 0.0 110.562 173.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -141.78 23.5 2.09 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.65 0.78 . . . . 0.0 108.967 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.73 -174.16 4.62 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.572 1.149 . . . . 0.0 109.577 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.73 11.57 5.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.068 0.547 . . . . 0.0 110.982 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.25 12.37 0.05 OUTLIER Glycine 0 CA--C 1.53 0.995 0 CA-C-O 119.193 -0.782 . . . . 0.0 113.122 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.2 p -138.4 -15.78 1.23 Allowed 'General case' 0 C--N 1.34 0.165 0 CA-C-N 118.373 1.087 . . . . 0.0 113.051 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -137.45 -30.84 0.83 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.12 -29.41 70.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 172.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.27 -35.65 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 122.521 0.329 . . . . 0.0 110.179 177.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.27 0.8 54.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.747 0.819 . . . . 0.0 112.319 -174.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.7 ppt_? -129.51 -18.84 3.49 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.201 0.455 . . . . 0.0 111.966 176.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.47 -14.54 61.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.047 0.385 . . . . 0.0 111.182 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -130.41 5.28 4.77 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.7 mt -138.68 18.8 2.69 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.172 0.589 . . . . 0.0 112.272 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.29 4.87 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -130.1 8.31 5.16 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.801 0.728 . . . . 0.0 111.845 -178.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 60.0 tpp -63.62 150.94 43.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.414 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 85.4 m -64.12 139.96 97.79 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 77.8 Cg_exo -52.73 -3.64 0.12 Allowed 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 124.739 3.626 . . . . 0.0 115.937 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -135.11 -24.98 1.4 Allowed 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.317 0.962 . . . . 0.0 112.285 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 90.4 p -69.38 -21.96 63.75 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.061 0.846 . . . . 0.0 109.432 174.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -68.09 -36.83 80.44 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -74.12 -36.14 64.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.34 73.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.736 -0.173 . . . . 0.0 110.81 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 46.8 tp -64.51 -46.91 80.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 6.2 mp -72.87 -11.35 60.56 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.239 -0.288 . . . . 0.0 111.178 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.0 tp -97.62 -7.37 31.22 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 p -140.59 0.67 1.66 Allowed 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.63 0.96 6.82 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.719 0.69 . . . . 0.0 111.575 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 5.7 ptp -156.29 21.84 0.36 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 177.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -146.27 -23.65 0.44 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.941 0.337 . . . . 0.0 111.798 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.03 8.55 83.21 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 118.797 -1.002 . . . . 0.0 114.728 170.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.21 145.95 49.4 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.336 1.568 . . . . 0.0 110.439 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 52.1 m -71.16 152.6 94.6 Favored Pre-proline 0 N--CA 1.455 -0.225 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.76 -27.16 32.94 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.621 2.881 . . . . 0.0 113.945 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -79.37 -39.07 33.47 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 118.061 0.392 . . . . 0.0 111.288 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -78.32 -31.22 48.68 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.27 -26.0 64.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.386 0.274 . . . . 0.0 111.063 176.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.56 -33.33 41.89 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 122.386 0.274 . . . . 0.0 110.595 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -70.29 -27.17 64.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.63 0.372 . . . . 0.0 110.764 177.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 19.7 tp -76.68 -8.44 57.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.427 HG13 HG22 ' A' ' 121' ' ' VAL . 23.0 pt -136.08 13.17 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.23 0.468 . . . . 0.0 111.609 178.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.93 55.93 7.21 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.427 HG22 HG13 ' A' ' 119' ' ' ILE . 22.4 m -136.32 179.89 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 C-N-CA 123.114 0.565 . . . . 0.0 110.313 175.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -82.63 159.76 22.61 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 176.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.5 m -57.53 -40.22 78.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 122.007 -0.433 . . . . 0.0 110.89 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -72.51 -20.81 61.29 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.655 0.382 . . . . 0.0 111.849 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -72.53 -36.7 68.36 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.635 -0.666 . . . . 0.0 109.97 176.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.24 -38.45 82.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.19 -32.86 73.55 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.56 0.164 . . . . 0.0 110.726 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.4 m -78.45 -39.37 38.79 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.43 -0.169 . . . . 0.0 110.751 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -65.34 -32.38 74.0 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 119.333 -0.365 . . . . 0.0 111.6 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.3 m -82.8 -29.17 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 CA-C-N 118.586 0.63 . . . . 0.0 110.912 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 50.9 m -67.42 -38.36 84.47 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -78.5 -27.17 46.08 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.347 -0.221 . . . . 0.0 110.658 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.37 67.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 117.833 0.288 . . . . 0.0 110.769 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.52 -22.37 57.16 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.193 -0.317 . . . . 0.0 111.232 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.66 -38.11 67.74 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.71 -26.24 61.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.351 -0.218 . . . . 0.0 110.489 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 15.3 mm -74.2 -51.18 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.14 -23.06 66.41 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -84.13 -10.74 57.54 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -153.67 -54.44 0.11 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -177.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 N--CA 1.469 0.503 0 C-N-CA 125.872 1.669 . . . . 0.0 114.982 -166.62 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p30 . . . . . 0 CA--C 1.53 0.185 0 N-CA-C 111.479 0.178 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -62.26 -26.8 68.59 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 118.034 0.379 . . . . 0.0 111.656 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.57 -36.18 58.89 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.79 -24.47 58.66 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.968 0.384 . . . . 0.0 110.813 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.86 -45.48 70.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 84.2 mt -76.49 -36.46 57.82 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.598 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -65.5 -42.46 92.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -64.01 -42.05 97.26 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.355 0.525 . . . . 0.0 111.028 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.13 -29.39 70.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.561 0.219 . . . . 0.0 111.463 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -102.86 -12.49 17.51 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.125 -0.359 . . . . 0.0 111.331 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . 0.491 HE21 ' CG ' ' B' ' 41' ' ' GLU . 62.9 tp60 -69.16 -34.11 74.46 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 175.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -73.89 -24.71 59.75 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 121.068 -0.253 . . . . 0.0 110.937 176.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 26.6 m -73.14 -12.14 60.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 27.2 pt -123.25 18.02 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.097 0 O-C-N 121.814 -0.554 . . . . 0.0 112.464 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . 0.491 ' CG ' HE21 ' B' ' 37' ' ' GLN . 74.0 mm-40 -132.85 25.29 4.32 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -177.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.42 -15.77 0.84 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -166.41 158.8 14.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.179 0.9 . . . . 0.0 111.451 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.84 150.49 59.89 Favored Pre-proline 0 C--O 1.233 0.185 0 C-N-CA 124.318 1.047 . . . . 0.0 108.536 171.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . 0.404 ' C ' ' H ' ' B' ' 47' ' ' GLU . 72.1 Cg_endo -73.83 -35.78 4.14 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.016 2.478 . . . . 0.0 112.588 -177.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.2 t70 49.28 -10.49 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 127.481 2.312 . . . . 0.0 116.231 -177.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' B' ' 45' ' ' PRO . 15.7 pt-20 -69.4 -16.97 63.61 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.921 -1.112 . . . . 0.0 111.831 -177.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 42.0 mtm -74.09 -12.22 60.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.95 0.5 . . . . 0.0 111.297 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' B' ' 49' ' ' LEU . 87.9 mt -108.37 -17.28 14.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -68.19 -21.08 64.89 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.425 ' O ' ' HE2' ' B' ' 54' ' ' LYS . 4.2 pp -98.68 -6.82 28.92 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 122.881 0.472 . . . . 0.0 112.174 177.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.442 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.9 mt -89.9 -15.19 32.66 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.918 0.781 . . . . 0.0 109.906 166.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.59 22.68 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.532 1.133 . . . . 0.0 111.296 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.442 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.5 pttt -135.16 -4.11 2.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.78 0.832 . . . . 0.0 112.087 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -155.96 -5.83 0.12 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.143 0 CA-C-N 118.958 0.799 . . . . 0.0 112.853 -176.831 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 m . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 111.524 0.194 . . . . 0.0 111.524 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.1 tp -52.63 -30.81 33.51 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.485 0.714 . . . . 0.0 112.597 -177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.97 -20.79 78.06 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.427 -176.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -79.07 -1.0 33.68 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 117.42 0.61 . . . . 0.0 111.684 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -134.1 -13.88 2.4 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.452 0.301 . . . . 0.0 111.594 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 tp -80.23 -42.08 23.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.197 -0.314 . . . . 0.0 110.166 173.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.453 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.37 -45.47 99.86 Favored Pre-proline 0 CA--C 1.531 0.219 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -175.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 74.3 Cg_endo -70.64 -4.16 14.05 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.373 2.048 . . . . 0.0 112.177 -178.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.31 10.17 4.84 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.413 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 48.3 mt -57.26 -40.34 84.0 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.351 -0.833 . . . . 0.0 112.434 173.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 88.1 Cg_endo -77.87 -16.47 14.44 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 CA-C-N 120.842 1.337 . . . . 0.0 112.634 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -69.66 -24.98 63.69 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 118.435 0.561 . . . . 0.0 109.867 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.71 -21.65 65.3 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 175.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -92.46 -22.19 19.74 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.488 0.315 . . . . 0.0 110.386 178.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.3 ttp180 -52.69 -29.02 24.34 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 124.271 1.028 . . . . 0.0 110.773 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -138.27 -9.69 1.49 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 111.433 0.16 . . . . 0.0 111.433 177.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.96 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.89 -29.98 66.21 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.99 0.895 . . . . 0.0 110.264 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.23 -2.01 32.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.431 0.692 . . . . 0.0 111.358 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.3 mt -114.9 5.13 15.02 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.629 0.772 . . . . 0.0 111.501 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.8 p -141.6 -22.63 0.73 Allowed 'General case' 0 C--O 1.231 0.109 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.86 17.29 50.14 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.287 0.494 . . . . 0.0 112.08 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.2 t -153.45 131.97 12.16 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.62 0.71 . . . . 0.0 110.023 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.94 -20.77 64.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.872 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -70.94 -38.5 72.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.065 0.393 . . . . 0.0 110.578 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -82.19 -28.25 32.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.21 0.204 . . . . 0.0 110.745 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.6 -39.03 26.56 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.781 -0.927 . . . . 0.0 110.781 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -73.31 -30.37 63.33 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.283 0.542 . . . . 0.0 111.088 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -25.22 27.68 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 120.178 -0.609 . . . . 0.0 111.413 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -63.57 -37.91 89.13 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.076 0.853 . . . . 0.0 109.442 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.3 t -63.79 -46.65 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 117.704 0.229 . . . . 0.0 110.772 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -79.21 -32.59 44.05 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.534 -175.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.53 -25.99 63.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.13 -43.76 94.28 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.88 -41.28 62.42 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.573 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -62.46 -26.75 68.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.121 -0.362 . . . . 0.0 111.823 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.59 0.63 29.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.898 0.479 . . . . 0.0 111.363 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 72.6 mt -120.66 -13.47 8.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.227 1.011 . . . . 0.0 109.866 -177.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.6 t -58.83 -11.48 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 123.62 0.768 . . . . 0.0 111.921 175.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.75 3.0 9.52 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 123.47 0.708 . . . . 0.0 110.579 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.12 53.66 0.96 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 123.888 0.875 . . . . 0.0 110.978 -174.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.23 -10.12 27.97 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.933 2.422 . . . . 0.0 113.264 -175.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -78.96 -17.84 54.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.415 0.552 . . . . 0.0 110.654 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -78.56 -1.19 32.81 Favored 'General case' 0 C--N 1.335 -0.062 0 C-N-CA 125.025 1.33 . . . . 0.0 111.464 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -131.26 60.51 53.3 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 123.559 0.744 . . . . 0.0 109.995 -176.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.25 171.52 15.88 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 124.057 3.172 . . . . 0.0 111.409 -176.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -115.51 12.84 16.29 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.167 0.987 . . . . 0.0 109.658 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -72.27 10.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.71 1.204 . . . . 0.0 111.507 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.95 174.87 12.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 124.386 1.074 . . . . 0.0 109.504 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -55.4 148.05 34.78 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -68.34 10.62 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 123.865 3.043 . . . . 0.0 112.139 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -129.08 -25.06 2.8 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.012 0.525 . . . . 0.0 111.18 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.82 -32.98 68.13 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.522 0.601 . . . . 0.0 110.189 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.38 -34.14 57.91 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 177.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.39 -43.65 96.98 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.961 0.381 . . . . 0.0 109.992 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.14 -32.23 44.32 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -62.46 -41.12 98.53 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.179 -0.326 . . . . 0.0 110.959 -178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -80.93 -29.94 35.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.665 -177.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -66.86 -35.89 81.08 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -67.38 -27.68 67.3 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.114 0.566 . . . . 0.0 109.807 176.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.07 -39.86 92.96 Favored Glycine 0 CA--C 1.528 0.871 0 CA-C-O 119.796 -0.447 . . . . 0.0 112.055 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 48.6 mm -72.9 -37.97 55.55 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.071 0 CA-C-N 118.132 0.966 . . . . 0.0 110.264 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -31.79 70.1 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -31.4 61.56 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 121.309 -0.869 . . . . 0.0 110.503 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.8 t -75.52 -28.04 58.96 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.587 0.355 . . . . 0.0 110.988 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.92 70.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 122.158 -0.339 . . . . 0.0 110.124 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -72.57 -16.03 61.75 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.382 -0.199 . . . . 0.0 110.954 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.27 4.36 39.28 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.888 0.475 . . . . 0.0 110.968 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -133.29 -4.33 3.03 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.41 0.684 . . . . 0.0 111.128 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.39 -4.98 62.45 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.591 -0.561 . . . . 0.0 113.186 175.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -67.17 135.07 52.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.891 0.845 . . . . 0.0 110.31 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -165.69 173.57 10.63 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.451 0.701 . . . . 0.0 110.58 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -147.37 168.52 21.61 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 124.231 1.012 . . . . 0.0 109.085 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.4 t -64.9 -21.37 66.8 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.795 0.438 . . . . 0.0 111.363 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 92.1 p 44.72 24.16 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.767 1.627 . . . . 0.0 114.226 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -56.01 -60.41 3.52 Favored 'General case' 0 CA--C 1.527 0.065 0 C-N-CA 123.139 0.576 . . . . 0.0 111.572 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 81.0 p -178.79 177.53 0.86 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 123.558 0.743 . . . . 0.0 110.635 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -138.18 17.74 2.79 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.365 1.066 . . . . 0.0 108.797 175.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.62 -173.59 4.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.188 0.995 . . . . 0.0 110.219 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -139.81 10.8 2.44 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.787 0.435 . . . . 0.0 112.014 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -167.62 9.28 0.05 OUTLIER Glycine 0 CA--C 1.529 0.958 0 CA-C-O 119.359 -0.689 . . . . 0.0 113.721 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.5 t -147.4 7.52 0.88 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.471 1.135 . . . . 0.0 111.946 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -152.43 -33.07 0.13 Allowed 'General case' 0 CA--C 1.528 0.117 0 O-C-N 121.935 -0.478 . . . . 0.0 109.79 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.12 -23.71 63.07 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.9 p -66.84 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.138 0 C-N-CA 122.664 0.386 . . . . 0.0 110.03 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.7 -17.12 52.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 122.732 0.413 . . . . 0.0 111.137 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -88.1 -51.34 5.85 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.26 -1.67 4.86 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -171.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -130.22 6.22 4.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.015 0.526 . . . . 0.0 111.996 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 84.9 mt -144.5 19.27 1.7 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.791 0.836 . . . . 0.0 110.782 -178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.51 5.95 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -130.39 0.97 4.57 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.337 0.971 . . . . 0.0 112.255 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 ttm -68.17 152.15 45.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.2 m -59.25 137.88 88.5 Favored Pre-proline 0 CA--C 1.532 0.251 0 C-N-CA 123.178 0.591 . . . . 0.0 109.667 176.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.36 5.42 1.55 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.933 3.089 . . . . 0.0 114.01 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -130.95 -32.68 1.62 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.632 0.651 . . . . 0.0 110.298 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.6 m -62.64 -19.38 63.74 Favored 'General case' 0 CA--C 1.527 0.069 0 O-C-N 121.852 -0.53 . . . . 0.0 110.39 173.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.83 -33.84 76.78 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.071 0.548 . . . . 0.0 110.517 175.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -77.59 -30.37 52.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.53 -32.35 73.07 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.07 -0.394 . . . . 0.0 110.289 175.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 38.2 tp -66.32 -44.13 84.25 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.763 0.425 . . . . 0.0 110.438 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.87 -10.01 59.08 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.456 0.571 . . . . 0.0 111.677 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.8 mt -96.58 -4.71 40.73 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 67.7 p -137.19 6.05 2.8 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -177.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -139.54 10.55 2.49 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 177.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.5 mtm -140.07 -10.11 1.14 Allowed 'General case' 0 C--N 1.341 0.216 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -148.1 -8.25 0.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.225 0.92 . . . . 0.0 112.634 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 70.22 20.0 76.26 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.296 -0.724 . . . . 0.0 113.848 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -58.0 150.6 20.38 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.64 1.22 . . . . 0.0 109.884 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.2 p -70.24 160.79 79.61 Favored Pre-proline 0 C--O 1.233 0.207 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.82 -16.07 45.25 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 121.933 1.755 . . . . 0.0 110.521 176.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -79.28 -37.43 37.85 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 117.94 0.336 . . . . 0.0 110.823 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -76.95 -36.09 56.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 117.938 0.335 . . . . 0.0 110.129 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.0 -27.53 64.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.591 -0.243 . . . . 0.0 111.227 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.97 -36.44 64.58 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.727 0.298 . . . . 0.0 110.575 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -68.52 -31.11 70.13 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.861 0.465 . . . . 0.0 110.688 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.86 -7.45 57.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 8.6 pt -135.72 13.92 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.739 0.699 . . . . 0.0 111.992 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 56.8 53.61 8.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 29.1 m -137.16 179.13 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 122.936 0.494 . . . . 0.0 110.399 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.31 161.32 20.48 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.758 0.423 . . . . 0.0 110.178 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.7 m -60.74 -36.55 79.19 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.057 -0.402 . . . . 0.0 110.919 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -23.95 61.48 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.371 0.268 . . . . 0.0 110.946 -178.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.39 -36.55 68.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.789 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.7 t -64.81 -36.5 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -62.87 -34.57 77.66 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.651 0.263 . . . . 0.0 110.594 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.1 m -77.03 -37.52 54.74 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 177.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mp -66.46 -32.79 74.38 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.074 -0.489 . . . . 0.0 111.694 -178.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.62 -26.59 12.52 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.873 0.761 . . . . 0.0 110.811 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 99.0 m -68.89 -37.72 79.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -76.34 -27.62 56.56 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 122.273 -0.267 . . . . 0.0 110.319 176.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.4 -48.07 62.22 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.852 0.296 . . . . 0.0 110.471 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.87 -22.74 65.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 117.855 0.298 . . . . 0.0 111.129 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.44 -38.62 59.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 173.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -69.46 -30.11 67.94 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 119.757 -0.163 . . . . 0.0 110.571 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.9 mm -64.71 -49.41 80.35 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.69 -20.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -77.76 -20.88 52.61 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -176.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -151.69 -10.63 0.21 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.4 p . . . . . 0 N--CA 1.464 0.257 0 CA-C-N 119.951 1.25 . . . . 0.0 112.164 179.092 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 . . . . . 0 CA--C 1.528 0.113 0 CA-C-O 120.672 0.272 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.2 tpt -52.93 -26.97 16.71 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.634 0.773 . . . . 0.0 112.349 -177.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.22 -40.54 87.7 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.24 -22.7 60.36 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.549 -0.383 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.88 -37.83 67.18 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 81.7 mt -73.97 -37.41 64.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.98 -32.45 72.86 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 119.533 -0.27 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 62.3 m -66.62 -43.86 83.62 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.221 0.464 . . . . 0.0 110.705 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -26.97 65.12 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -103.7 -16.54 15.43 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 122.111 -0.368 . . . . 0.0 111.526 -176.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tp60 -64.45 -33.67 76.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 169.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -55.15 -38.66 68.54 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.157 0.583 . . . . 0.0 110.646 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 95.6 m -67.06 -12.61 60.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.835 0.454 . . . . 0.0 112.208 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 69.6 mt -105.54 -14.89 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.048 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -75.54 19.51 0.19 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.855 0.462 . . . . 0.0 111.53 176.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -136.48 169.05 18.31 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.054 0.454 . . . . 0.0 111.055 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -56.37 165.31 1.11 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.761 1.224 . . . . 0.0 113.129 -173.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.5 m -125.92 155.61 72.79 Favored Pre-proline 0 C--O 1.232 0.169 0 C-N-CA 124.022 0.929 . . . . 0.0 109.663 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.9 179.62 6.32 Favored 'Trans proline' 0 N--CA 1.448 -1.152 0 C-N-CA 122.938 2.425 . . . . 0.0 109.898 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -146.77 0.25 0.75 Allowed 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.589 0.356 . . . . 0.0 111.071 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -67.81 -18.13 64.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -175.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.9 mpp? -70.22 -29.15 65.9 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-N 118.204 0.456 . . . . 0.0 109.8 176.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.45 ' N ' HD22 ' B' ' 49' ' ' LEU . 2.4 mm? -93.31 -25.02 17.92 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.49 -20.88 66.53 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.4 pp -98.11 0.61 46.39 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.492 0.317 . . . . 0.0 111.626 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' B' ' 52' ' ' LEU . 23.8 mt -83.84 -21.83 31.92 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 166.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -66.12 17.28 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.1 0.96 . . . . 0.0 113.155 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.4 pttt -128.12 6.18 5.92 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.427 0.691 . . . . 0.0 111.236 177.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.2 -15.51 0.35 Allowed 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.107 0.563 . . . . 0.0 111.591 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.342 0 CA-C-N 117.935 0.334 . . . . 0.0 110.697 171.184 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.233 0.225 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.52 -26.68 66.45 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.335 0.654 . . . . 0.0 111.228 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.95 -23.14 78.41 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.744 -0.598 . . . . 0.0 112.046 -176.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -81.17 2.99 25.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.865 0.466 . . . . 0.0 111.004 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -131.51 -21.71 2.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.532 0.733 . . . . 0.0 111.089 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.3 tp -78.55 -38.79 39.54 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.298 -0.251 . . . . 0.0 110.926 176.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.413 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.8 -45.78 99.78 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -172.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 77.4 Cg_endo -72.86 -3.84 14.31 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.487 2.125 . . . . 0.0 113.285 -175.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -135.71 8.7 3.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.368 0.531 . . . . 0.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.8 tp -56.38 -44.03 99.55 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 124.14 0.976 . . . . 0.0 113.107 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.484 ' HG2' HD11 ' B' ' 40' ' ' ILE . 67.6 Cg_endo -81.8 -11.76 11.26 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.203 1.936 . . . . 0.0 113.373 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -64.9 -23.49 67.24 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 118.942 0.792 . . . . 0.0 111.255 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.75 -19.03 65.67 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 122.252 -0.28 . . . . 0.0 110.9 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm105 -103.03 -20.91 14.02 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.702 0.401 . . . . 0.0 111.042 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -62.84 -16.43 58.44 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.364 0.529 . . . . 0.0 111.805 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -140.32 -21.3 0.84 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.578 0.351 . . . . 0.0 111.449 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.66 -25.1 68.61 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 111.56 -0.616 . . . . 0.0 111.56 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -66.86 -12.12 58.11 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.386 0.593 . . . . 0.0 111.977 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -114.12 -6.45 13.07 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 122.962 0.505 . . . . 0.0 111.881 -174.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.5 mt -82.76 -0.36 47.34 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.04 0.382 . . . . 0.0 111.22 174.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 t -148.29 -4.13 0.47 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -175.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.16 17.04 78.54 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 121.553 -0.717 . . . . 0.0 113.034 174.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.3 t -156.1 126.23 6.56 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.143 0.971 . . . . 0.0 110.272 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -69.32 -19.04 63.88 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.715 -0.22 . . . . 0.0 110.78 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -74.29 -33.14 63.15 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -76.46 -35.11 58.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -71.36 -36.1 63.28 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -73.02 -34.67 66.5 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 117.565 0.682 . . . . 0.0 111.451 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.82 -22.93 49.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.431 178.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -67.32 -36.79 82.19 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 37.3 t -60.4 -47.01 94.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 CA-C-N 117.932 0.333 . . . . 0.0 110.58 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -77.38 -29.86 53.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.511 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.67 -27.39 61.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.604 -0.147 . . . . 0.0 110.604 176.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 59.4 m -66.93 -38.9 87.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.43 -44.1 53.34 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -176.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.3 -24.67 67.74 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 122.081 -0.387 . . . . 0.0 110.522 -178.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.38 0.16 23.48 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.378 0.671 . . . . 0.0 111.636 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.5 mt -122.7 -14.02 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 124.008 0.923 . . . . 0.0 109.879 -177.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.0 t -58.92 -15.54 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.142 0.577 . . . . 0.0 112.021 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.19 4.98 9.77 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.344 0.658 . . . . 0.0 110.884 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.18 53.88 0.91 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.144 0.578 . . . . 0.0 111.199 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -64.7 -10.83 26.26 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.291 2.66 . . . . 0.0 112.405 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.57 -15.34 61.29 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.494 0.318 . . . . 0.0 110.878 175.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -85.68 0.5 52.54 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.722 0.409 . . . . 0.0 111.664 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -129.17 63.99 69.3 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 122.799 0.44 . . . . 0.0 110.296 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.24 168.36 21.1 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 124.214 3.276 . . . . 0.0 111.918 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.53 12.17 10.73 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.054 0.942 . . . . 0.0 109.795 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -72.68 10.68 0.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.196 0.998 . . . . 0.0 111.52 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.4 m -135.86 174.69 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 C-N-CA 124.2 1.0 . . . . 0.0 109.216 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.31 146.23 32.92 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.104 0.161 . . . . 0.0 110.824 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.07 11.78 0.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 124.242 3.294 . . . . 0.0 112.37 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -128.75 -16.6 4.18 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.028 0.531 . . . . 0.0 110.428 174.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.63 -35.87 38.75 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 118.136 0.426 . . . . 0.0 109.888 -178.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.61 -32.63 45.68 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.2 -46.6 89.17 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.059 0.543 . . . . 0.0 110.214 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -74.05 -33.85 63.85 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.721 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.6 tpm_? -63.77 -43.15 97.23 Favored 'General case' 0 C--N 1.337 0.05 0 CA-C-N 118.728 0.695 . . . . 0.0 111.116 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 88.8 mmm -71.0 -34.38 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.576 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -68.82 -37.07 78.94 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.325 -0.234 . . . . 0.0 110.748 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -67.94 -20.17 65.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.509 0.323 . . . . 0.0 110.377 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.1 -40.41 50.81 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.4 mm -73.61 -34.34 41.47 Favored 'Isoleucine or valine' 0 C--N 1.338 0.089 0 CA-C-N 117.552 0.676 . . . . 0.0 109.852 176.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.0 t90 -65.54 -36.36 83.57 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.419 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.06 69.53 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.082 -0.386 . . . . 0.0 110.563 177.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.1 t -75.07 -28.93 60.53 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.317 0.247 . . . . 0.0 110.743 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.02 64.77 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.334 -0.229 . . . . 0.0 111.049 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -86.64 -12.84 47.32 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.465 0.306 . . . . 0.0 110.758 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.4 4.56 34.84 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.191 0.596 . . . . 0.0 111.131 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -137.7 0.82 2.27 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.107 0.563 . . . . 0.0 111.033 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.34 13.13 83.12 Favored Glycine 0 CA--C 1.528 0.885 0 CA-C-O 119.676 -0.514 . . . . 0.0 113.12 176.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -64.25 -18.38 64.5 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 117.949 0.875 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.42 155.15 31.61 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.119 0.968 . . . . 0.0 109.095 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -146.89 -10.68 0.45 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.8 t -164.52 174.52 10.82 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.767 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.7 p -155.82 167.3 30.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.736 0.814 . . . . 0.0 110.087 177.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -152.29 -50.34 0.11 Allowed 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 122.452 -0.155 . . . . 0.0 111.279 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -169.31 160.49 9.49 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.506 0.322 . . . . 0.0 110.985 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -160.24 23.73 0.16 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.082 0.953 . . . . 0.0 110.037 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.39 174.75 10.47 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.163 0.506 . . . . 0.0 111.227 -176.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -9.38 17.32 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.86 -11.79 0.14 Allowed Glycine 0 CA--C 1.527 0.828 0 CA-C-O 119.566 -0.575 . . . . 0.0 113.121 178.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.5 p -66.65 -3.54 6.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.295 1.047 . . . . 0.0 113.066 -176.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -129.19 -29.76 2.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.92 68.27 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -65.89 -29.86 48.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.444 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -0.06 53.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.395 0.678 . . . . 0.0 111.809 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -130.48 -16.59 3.43 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.865 0.302 . . . . 0.0 111.229 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.45 -1.42 15.67 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.855 0.462 . . . . 0.0 110.447 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -130.49 -12.87 3.88 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.352 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 73.8 mt -144.82 34.21 1.13 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.338 0.655 . . . . 0.0 111.247 -171.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.7 2.88 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -130.52 -5.92 4.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.532 1.06 . . . . 0.0 112.3 -177.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.8 ttm -67.35 146.05 54.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.325 0.511 . . . . 0.0 110.31 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 93.9 m -65.65 137.25 96.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.83 -20.75 39.05 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.578 2.185 . . . . 0.0 112.956 -174.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -78.61 -34.73 46.43 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.3 m -65.36 -23.41 66.98 Favored 'General case' 0 N--CA 1.457 -0.105 0 O-C-N 122.043 -0.411 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 62.6 mtm180 -67.88 -26.0 65.79 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.063 0.392 . . . . 0.0 110.556 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -77.72 -39.0 45.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.57 -33.25 74.65 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 122.082 -0.386 . . . . 0.0 110.202 177.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -54.43 46.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.974 0.509 . . . . 0.0 109.721 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.504 ' HA ' ' HE3' ' A' ' 107' ' ' MET . 4.4 pp -71.53 -15.44 62.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.1 mt -84.24 -9.3 58.63 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.882 0.31 . . . . 0.0 111.827 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.4 p -135.44 12.47 3.5 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -132.48 -0.65 3.57 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.504 ' HE3' ' HA ' ' A' ' 103' ' ' LEU . 33.3 mtm -145.9 -11.79 0.5 Allowed 'General case' 0 C--N 1.34 0.173 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -138.09 -2.91 1.82 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.23 0.923 . . . . 0.0 112.266 -175.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 55.58 26.47 45.81 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.167 -0.796 . . . . 0.0 114.315 173.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -56.68 151.62 13.63 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.493 1.146 . . . . 0.0 110.633 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.4 t -64.55 149.38 95.46 Favored Pre-proline 0 N--CA 1.453 -0.285 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 171.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -64.44 -16.54 55.67 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.938 1.759 . . . . 0.0 110.648 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -76.18 -39.85 53.81 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 117.767 0.258 . . . . 0.0 110.344 176.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -74.63 -35.26 62.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 122.119 -0.363 . . . . 0.0 110.312 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.04 -28.1 67.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.22 -0.3 . . . . 0.0 111.053 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.32 -27.69 42.1 Favored 'General case' 0 CA--C 1.526 0.05 0 C-N-CA 122.541 0.336 . . . . 0.0 110.403 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -75.13 -22.62 58.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.258 1.023 . . . . 0.0 111.037 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 69.8 mt -88.49 -7.88 55.8 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 7.5 pt -135.55 15.23 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.726 0.694 . . . . 0.0 111.351 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 46.13 62.17 2.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.952 1.701 . . . . 0.0 114.691 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 31.2 m -136.9 -179.78 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 C-N-CA 124.077 0.951 . . . . 0.0 109.392 174.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -81.41 159.93 24.19 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -60.6 -36.87 79.62 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 122.152 -0.342 . . . . 0.0 110.799 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.0 t -72.91 -24.64 60.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.134 0.174 . . . . 0.0 110.932 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.95 -34.14 68.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.085 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.9 t -65.72 -38.04 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.109 0 CA-C-N 118.211 0.46 . . . . 0.0 109.769 177.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.66 -35.78 77.07 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.7 m -76.29 -37.98 56.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.342 -0.224 . . . . 0.0 110.743 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mp -65.17 -36.19 83.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.666 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.44 -28.5 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-N 118.515 0.598 . . . . 0.0 110.974 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.7 m -68.67 -38.79 80.65 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -78.17 -26.17 47.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 122.356 -0.215 . . . . 0.0 110.638 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.21 -50.74 37.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.57 -22.51 65.38 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 117.73 0.241 . . . . 0.0 111.1 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.29 -34.77 76.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -81.59 -18.62 44.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.261 176.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 25.9 mm -68.91 -53.13 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 173.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.65 -16.83 62.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -64.91 -21.44 66.82 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -155.57 -43.32 0.08 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -171.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -169.097 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 25.0 t70 . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 120.92 0.391 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -64.42 -25.65 68.11 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.968 0.507 . . . . 0.0 112.136 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.48 -34.69 60.14 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.63 -18.54 60.54 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 117.325 0.562 . . . . 0.0 110.865 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.63 -41.15 27.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 62.0 mt -71.02 -41.56 70.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.255 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -70.84 -25.9 63.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.928 -0.482 . . . . 0.0 111.314 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 45.5 t -64.74 -44.82 88.89 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.791 0.723 . . . . 0.0 109.769 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.4 -24.62 65.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -105.36 -1.51 25.02 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 122.088 -0.382 . . . . 0.0 111.62 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -79.79 -40.09 29.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -66.88 -16.88 64.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 175.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -88.01 -8.34 55.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.371 0.668 . . . . 0.0 112.496 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.484 HD11 ' HG2' ' A' ' 12' ' ' PRO . 7.2 tp -123.22 -7.95 7.88 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 CA-C-N 119.334 0.97 . . . . 0.0 112.909 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -80.6 33.62 0.31 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.173 0.589 . . . . 0.0 112.036 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -130.87 175.57 8.95 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.113 0.482 . . . . 0.0 111.918 -174.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -64.04 178.05 0.71 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.704 1.201 . . . . 0.0 112.747 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.59 156.04 74.96 Favored Pre-proline 0 CA--C 1.53 0.192 0 C-N-CA 122.918 0.487 . . . . 0.0 110.998 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -77.67 -178.86 4.92 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.577 2.851 . . . . 0.0 110.044 173.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -148.65 -1.9 0.5 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -66.51 -20.49 66.04 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.939 -0.476 . . . . 0.0 111.905 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 3.1 mpp? -67.93 -36.81 80.77 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' B' ' 49' ' ' LEU . 82.6 mt -83.43 -12.46 56.38 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.117 -0.364 . . . . 0.0 110.213 178.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -72.43 -20.57 61.39 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.937 -0.477 . . . . 0.0 109.882 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -73.63 -19.57 60.82 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 173.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.423 ' C ' ' H ' ' B' ' 54' ' ' LYS . 15.8 mt -78.93 -22.6 45.53 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.136 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -73.41 9.38 1.35 Allowed 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 172.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' B' ' 52' ' ' LEU . 36.9 ttpt -120.72 -0.55 10.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.064 1.346 . . . . 0.0 110.588 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.2 pp -149.65 -15.36 0.27 Allowed 'General case' 0 C--N 1.345 0.374 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 CA-C-N 118.668 0.667 . . . . 0.0 112.399 -178.671 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m . . . . . 0 CA--C 1.534 0.329 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.6 tp -63.42 -30.56 71.67 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 122.186 -0.321 . . . . 0.0 111.488 -177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -65.66 -35.42 91.06 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.3 mp0 -73.4 3.33 6.11 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.399 0.68 . . . . 0.0 111.115 177.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -128.42 0.58 5.65 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.283 0.633 . . . . 0.0 111.078 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.66 -39.54 2.74 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.952 0.501 . . . . 0.0 111.091 177.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.427 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.99 -44.78 99.62 Favored Pre-proline 0 CA--C 1.53 0.209 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -175.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 82.9 Cg_endo -75.71 3.48 5.93 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.173 1.916 . . . . 0.0 111.907 -179.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -130.28 9.42 5.19 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.9 mt -54.86 -44.24 99.29 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.58 -15.0 11.24 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 121.715 1.61 . . . . 0.0 112.708 -175.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -71.59 -25.33 62.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.462 0.573 . . . . 0.0 111.221 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.9 mt -69.53 -27.32 65.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 118.145 0.429 . . . . 0.0 110.009 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -88.76 -29.18 19.98 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.53 0.732 . . . . 0.0 110.544 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.5 ttp180 -53.83 -25.58 20.2 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.674 1.19 . . . . 0.0 112.759 -175.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -140.56 -20.98 0.83 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.25 -27.99 70.09 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -69.26 -33.01 72.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 117.557 0.679 . . . . 0.0 110.289 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.95 -11.44 59.9 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.0 mt -86.07 4.39 38.34 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.03 0.377 . . . . 0.0 111.213 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.8 t -149.31 -18.13 0.28 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.97 11.24 82.87 Favored Glycine 0 CA--C 1.526 0.719 0 CA-C-O 119.47 -0.628 . . . . 0.0 113.75 171.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -148.28 140.03 23.79 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.349 1.075 . . . . 0.0 110.864 -179.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -73.36 -19.22 61.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.365 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -73.72 -37.68 65.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 178.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -79.67 -32.59 41.49 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 176.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.4 -47.1 82.49 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.81 -33.02 74.73 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.594 0.697 . . . . 0.0 110.313 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.496 ' HE3' ' CE1' ' A' ' 31' ' ' TYR . 5.9 tmmm? -67.5 -46.78 71.93 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.63 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.496 ' CE1' ' HE3' ' A' ' 30' ' ' LYS . 22.7 m-85 -69.06 -36.07 77.24 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.392 0.542 . . . . 0.0 111.552 -178.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 t -60.81 -52.25 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -77.29 -27.83 53.14 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 122.423 -0.173 . . . . 0.0 111.375 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -24.24 63.23 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.721 -0.181 . . . . 0.0 110.847 175.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.0 m -67.82 -40.08 83.83 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -73.59 -42.25 61.81 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.138 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -59.63 -25.49 64.71 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.995 -0.44 . . . . 0.0 111.858 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 0.49 31.33 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.797 0.439 . . . . 0.0 111.011 178.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 81.6 mt -120.9 -13.89 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -61.79 -10.64 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.87 0.868 . . . . 0.0 111.708 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.7 3.0 9.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.001 0.52 . . . . 0.0 111.296 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.1 55.36 0.97 Allowed Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.385 0.674 . . . . 0.0 110.304 -177.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.47 -10.63 28.45 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 123.318 2.679 . . . . 0.0 112.753 -173.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -81.52 -11.69 59.09 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 122.067 -0.395 . . . . 0.0 111.005 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -86.73 -14.61 41.92 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -65.31 114.9 17.26 Favored Pre-proline 0 CA--C 1.529 0.165 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -78.78 135.29 12.64 Favored 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 122.991 2.461 . . . . 0.0 112.193 -174.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -125.76 1.91 7.45 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 125.054 1.342 . . . . 0.0 109.976 175.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -79.42 9.56 4.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.086 0.954 . . . . 0.0 111.719 -178.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.3 m -137.93 -179.08 2.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 C-N-CA 123.846 0.858 . . . . 0.0 109.967 -176.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -52.65 152.96 6.07 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.301 0.641 . . . . 0.0 110.81 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.78 7.3 0.59 Allowed 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.383 3.389 . . . . 0.0 112.588 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -127.17 -25.02 3.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.221 0.608 . . . . 0.0 110.843 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 54' ' ' LEU . 28.7 mt -70.31 -33.9 72.08 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.039 0.381 . . . . 0.0 110.648 178.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.97 -41.0 93.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.62 -42.47 91.5 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.975 0.51 . . . . 0.0 109.977 177.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -77.47 -30.25 53.07 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -175.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -66.12 -41.99 89.76 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.71 0.687 . . . . 0.0 110.754 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.1 mmm -71.12 -34.76 71.37 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.502 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -71.0 -35.07 71.94 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 117.618 0.19 . . . . 0.0 110.752 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.25 -27.65 68.8 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.516 0.326 . . . . 0.0 110.204 177.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -72.71 -36.39 58.23 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -70.59 -38.24 72.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.101 0 CA-C-N 117.657 0.729 . . . . 0.0 110.142 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 76.0 t90 -69.29 -32.04 70.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 122.251 -0.281 . . . . 0.0 110.897 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.82 -32.94 68.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 122.099 -0.376 . . . . 0.0 110.179 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -74.11 -25.49 59.81 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.597 0.359 . . . . 0.0 110.484 178.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.38 65.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 122.392 -0.192 . . . . 0.0 110.626 179.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -69.79 -16.52 63.3 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.115 -0.366 . . . . 0.0 110.614 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.48 7.51 46.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.23 0.612 . . . . 0.0 111.208 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -134.24 -4.89 2.68 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 111.66 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 112.88 25.56 4.46 Favored Glycine 0 C--N 1.341 0.825 0 C-N-CA 120.911 -0.662 . . . . 0.0 114.372 173.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -128.64 171.53 12.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.558 1.179 . . . . 0.0 110.637 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 51.01 25.69 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.195 0.998 . . . . 0.0 112.576 -176.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -67.51 -7.19 23.85 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -152.42 -19.87 0.17 Allowed 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.292 0.496 . . . . 0.0 111.706 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.0 m 49.85 26.4 1.92 Allowed 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -56.54 153.12 10.63 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.767 0.427 . . . . 0.0 110.071 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.4 p -136.47 170.68 15.66 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.791 0.436 . . . . 0.0 110.922 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -152.92 23.3 0.57 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.946 0.498 . . . . 0.0 111.291 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.72 162.03 2.51 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.958 -0.464 . . . . 0.0 111.734 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.25 -13.55 62.33 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -173.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.62 20.39 0.06 OUTLIER Glycine 0 CA--C 1.527 0.791 0 CA-C-O 119.421 -0.655 . . . . 0.0 113.448 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 8.9 t -134.18 5.45 3.54 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.304 1.052 . . . . 0.0 112.322 -176.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -150.97 -30.1 0.19 Allowed 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.42 -22.79 65.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.6 p -71.53 -29.9 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.586 0.354 . . . . 0.0 110.328 176.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.71 7.7 28.94 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.774 0.83 . . . . 0.0 111.568 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -127.97 -40.37 1.7 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.389 0.676 . . . . 0.0 110.062 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.2 -1.77 8.76 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.525 0.33 . . . . 0.0 111.786 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 63.6 mtt180 -130.84 -3.0 4.1 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 123.022 0.529 . . . . 0.0 111.926 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.429 HD21 HD13 ' A' ' 137' ' ' ILE . 73.6 mt -136.35 14.59 3.24 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.362 0.528 . . . . 0.0 111.51 -172.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.79 18.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.424 1.09 . . . . 0.0 112.124 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 91' ' ' LEU . 85.2 mmt-85 -126.34 11.28 7.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.373 0.669 . . . . 0.0 112.064 -174.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 20.4 ptp -122.78 164.5 18.24 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 117.921 0.328 . . . . 0.0 110.304 175.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 63.5 m -62.45 143.29 96.09 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 123.258 0.623 . . . . 0.0 110.286 -176.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -53.06 -0.62 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 124.95 3.767 . . . . 0.0 115.139 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 31.1 tp -119.47 -19.44 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.406 0.548 . . . . 0.0 110.564 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.6 m -69.1 -27.72 65.85 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 mtp-105 -69.9 -26.79 64.33 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.525 0.33 . . . . 0.0 110.16 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -81.06 -39.34 25.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.13 -34.36 77.88 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.15 -49.26 68.03 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.557 0.343 . . . . 0.0 110.812 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.71 -4.65 35.8 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 115' ' ' ALA . 14.7 tp -106.64 -4.44 19.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.817 0.447 . . . . 0.0 111.772 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 72.8 p -140.11 5.02 2.08 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.9 -1.06 6.61 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.587 0.631 . . . . 0.0 112.541 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.433 ' HE2' ' HB2' ' B' ' 32' ' ' LEU . 8.3 ptp -150.71 12.27 0.69 Allowed 'General case' 0 C--N 1.338 0.091 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -143.75 -12.26 0.67 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.723 0.692 . . . . 0.0 111.995 176.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 67.2 15.07 64.92 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.994 -0.892 . . . . 0.0 114.135 173.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -60.93 146.68 45.91 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.844 1.322 . . . . 0.0 110.231 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.7 m -65.98 153.51 91.46 Favored Pre-proline 0 N--CA 1.454 -0.24 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.51 -17.26 43.56 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.555 2.17 . . . . 0.0 111.24 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -74.93 -34.39 62.1 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 117.847 0.294 . . . . 0.0 110.711 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -82.26 -34.54 28.73 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.423 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -67.0 -27.48 67.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.437 0.295 . . . . 0.0 110.698 175.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.71 -32.91 53.23 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.46 -23.53 62.71 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.397 0.679 . . . . 0.0 111.213 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -88.82 -5.32 58.12 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 16.9 pt -135.13 12.07 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 O-C-N 121.875 -0.515 . . . . 0.0 111.071 176.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 54.42 58.22 5.12 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.898 1.279 . . . . 0.0 113.566 176.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.47 -178.71 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.807 0.843 . . . . 0.0 109.816 176.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -83.96 160.79 20.98 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.3 m -58.67 -36.96 74.99 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 122.018 -0.427 . . . . 0.0 110.912 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 97.6 p -72.66 -20.93 61.16 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -76.27 -33.38 59.12 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 121.97 -0.456 . . . . 0.0 110.084 178.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.9 t -66.22 -37.56 79.98 Favored 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.69 -32.19 73.22 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.444 0.164 . . . . 0.0 110.858 177.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.4 m -76.1 -39.43 55.27 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.515 177.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.44 -33.78 76.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.224 -0.417 . . . . 0.0 111.456 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.2 m -78.5 -26.44 13.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.138 0 CA-C-N 118.765 0.711 . . . . 0.0 111.12 177.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 60.7 m -68.45 -40.08 81.22 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.1 -27.42 60.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.8 -48.68 36.0 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 122.473 -0.142 . . . . 0.0 110.653 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 117.909 0.322 . . . . 0.0 111.731 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.82 -41.0 62.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 174.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -72.35 -22.24 61.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 119.513 -0.279 . . . . 0.0 110.461 178.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.429 HD13 HD21 ' A' ' 91' ' ' LEU . 12.7 mm -75.29 -44.3 42.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.514 0.597 . . . . 0.0 109.745 176.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -69.51 -20.48 63.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -94.7 -8.02 38.99 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -172.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -155.29 -12.06 0.11 Allowed 'General case' 0 C--N 1.34 0.193 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -175.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 41.1 p . . . . . 0 N--CA 1.467 0.387 0 CA-C-N 119.941 1.246 . . . . 0.0 112.354 -178.804 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 CA--C 1.532 0.278 0 N-CA-C 111.562 0.208 . . . . 0.0 111.562 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.7 tpt -58.5 -26.6 63.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -70.43 -34.24 68.28 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.8 -22.16 43.41 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 117.285 0.543 . . . . 0.0 110.541 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.98 71.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.816 0.341 . . . . 0.0 110.099 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.433 ' HB2' ' HE2' ' A' ' 107' ' ' MET . 90.7 mt -74.78 -31.62 61.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.219 178.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -67.72 -37.66 82.53 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 117.94 0.336 . . . . 0.0 110.42 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -65.86 -37.23 85.64 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.833 0.288 . . . . 0.0 110.499 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.74 -29.12 68.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -102.23 -14.08 17.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 O-C-N 122.083 -0.386 . . . . 0.0 111.585 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -66.99 -36.76 82.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.78 -31.96 70.16 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.621 0.368 . . . . 0.0 110.791 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 96.1 m -73.68 -8.95 58.02 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.228 0.611 . . . . 0.0 112.327 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 16.7 tt -123.54 -7.18 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 118.77 0.714 . . . . 0.0 111.776 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.11 24.38 0.13 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.406 -0.809 . . . . 0.0 110.714 171.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -131.94 171.92 12.98 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.485 0.714 . . . . 0.0 111.179 -175.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -67.54 -177.34 0.73 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.399 1.079 . . . . 0.0 112.113 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 35.2 m -132.39 150.36 75.72 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.809 0.844 . . . . 0.0 109.231 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.29 -25.98 5.39 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.169 2.58 . . . . 0.0 113.051 -175.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 51.89 4.07 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.881 1.272 . . . . 0.0 114.015 -176.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -66.0 -22.12 66.44 Favored 'General case' 0 CA--C 1.528 0.108 0 O-C-N 121.461 -0.774 . . . . 0.0 111.243 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 27.6 mtm -70.71 -34.2 71.68 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.661 0.384 . . . . 0.0 111.017 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 71.7 mt -82.52 -15.03 53.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.888 -0.507 . . . . 0.0 109.884 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -70.31 -20.49 63.01 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.995 -0.441 . . . . 0.0 109.837 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.03 -14.7 61.47 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.192 -0.318 . . . . 0.0 110.655 173.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.427 ' C ' ' H ' ' B' ' 54' ' ' LYS . 31.1 mt -86.72 -20.93 26.97 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.093 173.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -69.84 16.23 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.705 0.402 . . . . 0.0 111.928 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.427 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -135.04 5.41 3.3 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.724 0.81 . . . . 0.0 111.175 177.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.425 HD12 ' C ' ' B' ' 55' ' ' LEU . 2.5 pp -151.52 -2.73 0.31 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 177.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.237 0 CA-C-N 118.426 0.557 . . . . 0.0 110.101 175.983 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.6 tp -60.98 -35.75 77.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 121.974 0.11 . . . . 0.0 111.099 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.85 -29.16 67.63 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.168 -177.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -74.91 0.91 14.1 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.545 0.738 . . . . 0.0 110.251 176.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -137.12 8.37 2.95 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.419 1.088 . . . . 0.0 110.687 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.6 tp -118.31 -38.89 3.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.223 0.609 . . . . 0.0 110.622 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.433 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.77 -44.58 97.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.433 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 95.8 Cg_endo -74.09 -0.22 9.27 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.282 1.988 . . . . 0.0 112.631 -176.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.422 ' CE1' ' HE ' ' A' ' 53' ' ' ARG . 39.1 m-70 -133.67 3.17 3.52 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.017 0.527 . . . . 0.0 111.158 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.433 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 55.2 tp -59.64 -43.49 95.63 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 124.632 1.173 . . . . 0.0 113.786 -177.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.433 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 92.8 Cg_endo -75.0 -10.67 21.32 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.741 1.628 . . . . 0.0 112.367 -176.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-30 -66.57 -22.59 66.14 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.594 0.634 . . . . 0.0 111.365 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -74.05 -17.15 61.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.209 -0.307 . . . . 0.0 110.557 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.7 ttt85 -105.06 -26.25 12.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.763 0.425 . . . . 0.0 111.221 -175.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -61.68 -19.6 62.52 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 122.877 0.471 . . . . 0.0 111.647 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -136.83 -11.88 1.75 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.423 0.289 . . . . 0.0 111.143 175.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.27 -38.64 96.55 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 177.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.9 mtm105 -68.69 -24.9 64.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.105 0.953 . . . . 0.0 110.423 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.42 4.15 36.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.691 0.797 . . . . 0.0 111.253 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 tp -126.74 4.59 6.69 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.979 0.912 . . . . 0.0 110.297 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.3 p -135.81 -9.52 2.1 Favored 'General case' 0 C--N 1.338 0.078 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.76 2.36 44.41 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-O 119.494 -0.615 . . . . 0.0 114.093 173.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 t -157.03 140.08 15.38 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.262 1.031 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -66.54 -20.99 66.16 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.207 177.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -78.81 -32.03 46.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -79.01 -40.24 31.98 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.45 -32.31 83.72 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -71.88 -39.71 69.43 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 117.129 0.465 . . . . 0.0 111.264 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -26.43 30.77 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 120.458 -0.497 . . . . 0.0 112.122 -177.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -69.17 -35.43 76.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 119.097 0.862 . . . . 0.0 110.059 176.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.0 t -65.01 -43.71 96.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.147 0 CA-C-O 120.643 0.259 . . . . 0.0 110.526 176.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.3 ttp-105 -78.76 -28.48 44.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 122.302 -0.249 . . . . 0.0 111.661 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.57 -29.73 65.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 65.0 m -65.15 -37.88 88.82 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.4 OUTLIER -77.8 -42.72 32.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -177.037 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -63.41 -24.66 67.94 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.795 -0.565 . . . . 0.0 110.475 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.14 -0.08 26.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.406 0.682 . . . . 0.0 111.528 176.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 92.2 mt -120.24 -15.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.836 0.854 . . . . 0.0 109.696 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.02 -14.37 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.367 0.667 . . . . 0.0 110.775 173.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.85 4.41 9.43 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.679 0.792 . . . . 0.0 110.937 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.28 55.5 1.41 Allowed Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.33 0.652 . . . . 0.0 111.494 -177.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -68.43 -4.72 13.48 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.368 2.045 . . . . 0.0 110.868 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -85.81 4.11 38.53 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.2 1.0 . . . . 0.0 111.662 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -131.26 20.88 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.119 0.418 . . . . 0.0 111.358 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -131.83 53.67 12.09 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.457 0.703 . . . . 0.0 110.073 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.77 171.72 17.67 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.148 3.232 . . . . 0.0 112.752 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.416 ' C ' ' H ' ' A' ' 50' ' ' VAL . 5.1 mpt_? -113.08 18.82 17.72 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.179 1.392 . . . . 0.0 110.126 175.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.09 4.41 0.9 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.989 0.916 . . . . 0.0 110.809 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.416 ' H ' ' C ' ' A' ' 48' ' ' ARG . 30.4 m -135.73 177.75 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 125.462 1.505 . . . . 0.0 108.494 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -57.93 148.47 59.46 Favored Pre-proline 0 C--O 1.232 0.173 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.33 10.69 0.53 Allowed 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.793 2.995 . . . . 0.0 111.666 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HE ' ' CE1' ' A' ' 10' ' ' HIS . 98.9 mtt180 -126.52 -16.67 5.27 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 124.029 0.932 . . . . 0.0 110.613 177.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -45.3 64.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.47 -32.83 82.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.68 -50.08 74.38 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.227 -0.656 . . . . 0.0 109.227 178.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -76.71 -29.64 56.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.572 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -68.14 -42.03 80.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 119.671 -0.204 . . . . 0.0 111.145 -176.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.4 mmm -79.41 -31.31 42.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.994 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -68.02 -38.82 83.01 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.939 0.336 . . . . 0.0 110.212 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 tm0? -70.74 -25.2 62.82 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 122.506 0.322 . . . . 0.0 110.199 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.77 -39.75 85.66 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -72.34 -36.75 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.109 0 CA-C-N 118.194 0.997 . . . . 0.0 109.698 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -68.71 -35.61 77.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.522 -0.111 . . . . 0.0 110.916 -177.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.44 -31.12 66.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 176.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -72.48 -28.01 62.64 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.05 -36.7 58.93 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.384 -0.198 . . . . 0.0 110.549 177.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -73.51 -14.07 61.15 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.298 -0.251 . . . . 0.0 110.488 175.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.18 9.49 39.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.426 0.691 . . . . 0.0 110.458 176.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.3 -8.52 3.35 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.076 0.551 . . . . 0.0 111.056 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 149.91 -22.46 1.14 Allowed Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.311 -0.716 . . . . 0.0 114.708 173.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.07 140.01 58.78 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.424 1.112 . . . . 0.0 110.771 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -174.54 15.65 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.655 0.782 . . . . 0.0 111.516 178.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -84.28 170.91 13.19 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.11 0.481 . . . . 0.0 110.699 -176.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -64.13 152.7 39.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.005 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.7 p -164.33 9.25 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -175.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -63.51 -11.02 20.72 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -169.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.7 p -158.7 167.59 29.12 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.944 0.793 . . . . 0.0 112.05 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -149.31 19.11 0.95 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.135 0.974 . . . . 0.0 110.522 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.29 -171.57 3.87 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.481 0.712 . . . . 0.0 109.918 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -134.02 12.11 3.94 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.802 0.441 . . . . 0.0 111.604 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -163.9 9.56 0.08 OUTLIER Glycine 0 CA--C 1.53 0.97 0 CA-C-O 119.702 -0.499 . . . . 0.0 114.054 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 t -148.0 -0.25 0.61 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.106 0.953 . . . . 0.0 111.71 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -141.95 -36.16 0.43 Allowed 'General case' 0 C--O 1.228 -0.056 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.05 -28.79 69.11 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.06 -32.39 54.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.738 0.304 . . . . 0.0 110.561 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.23 0.09 55.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.42 0.688 . . . . 0.0 112.296 -175.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -132.26 -12.21 3.18 Favored 'General case' 0 C--O 1.227 -0.119 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.3 -3.42 36.61 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 173.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.507 ' C ' HD22 ' A' ' 91' ' ' LEU . 70.9 mtt85 -122.62 -12.49 8.11 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.75 0.82 . . . . 0.0 111.03 177.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.507 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.4 mm? -134.8 36.04 3.1 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.661 1.184 . . . . 0.0 110.085 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.412 ' C ' ' HD2' ' A' ' 93' ' ' ARG . . . -61.19 9.23 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.412 ' HD2' ' C ' ' A' ' 92' ' ' ALA . 2.8 mpt_? -130.42 0.42 4.52 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.922 0.783 . . . . 0.0 111.798 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.5 ttm -69.28 144.07 53.69 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.569 0.622 . . . . 0.0 109.797 177.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.441 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 24.2 m -67.19 137.47 94.19 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 123.052 0.541 . . . . 0.0 110.74 -178.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 50.6 Cg_exo -55.5 2.98 0.07 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 125.133 3.888 . . . . 0.0 115.448 176.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -128.63 -33.75 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.816 0.735 . . . . 0.0 109.937 -176.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 51.0 m -64.91 -25.42 67.88 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 121.922 -0.486 . . . . 0.0 110.115 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -70.46 -29.56 66.15 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 122.563 0.345 . . . . 0.0 110.413 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -72.71 -37.85 67.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.66 -31.56 68.52 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.082 -0.386 . . . . 0.0 110.173 176.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.49 -47.01 77.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.17 -11.16 60.43 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.712 -0.617 . . . . 0.0 111.544 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 65.2 mt -91.4 -5.1 54.95 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.103 -0.373 . . . . 0.0 111.627 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 68.5 p -135.55 6.32 3.23 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.58 7.91 1.94 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.059 0.544 . . . . 0.0 111.229 177.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.6 mtm -146.61 -2.1 0.67 Allowed 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -176.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -150.18 -17.59 0.25 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.919 0.781 . . . . 0.0 112.17 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 74.4 16.31 79.97 Favored Glycine 0 C--N 1.34 0.784 0 CA-C-O 119.345 -0.697 . . . . 0.0 114.005 173.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -61.27 149.88 36.49 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.639 1.22 . . . . 0.0 110.192 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.8 m -73.73 156.0 88.65 Favored Pre-proline 0 C--O 1.232 0.162 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -53.15 -27.18 36.14 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 123.198 2.598 . . . . 0.0 113.248 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.13 -33.89 70.52 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.938 -0.476 . . . . 0.0 110.798 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -83.53 -35.54 24.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.66 -29.6 67.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.148 0.179 . . . . 0.0 111.351 178.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.18 -32.93 50.32 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.574 0.226 . . . . 0.0 110.662 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -69.11 -30.87 69.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 52.5 mt -75.51 -6.5 50.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 10.1 pt -135.24 11.2 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 118.796 0.725 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 53.78 56.18 7.51 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.857 1.263 . . . . 0.0 113.955 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.4 m -135.98 176.08 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 C-N-CA 123.455 0.702 . . . . 0.0 110.183 175.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -73.31 156.77 38.09 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 120.859 0.362 . . . . 0.0 110.333 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 33.3 m -60.48 -35.9 77.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 121.95 -0.469 . . . . 0.0 110.978 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 89.5 p -75.54 -21.3 58.05 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.976 -0.453 . . . . 0.0 111.512 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -74.44 -43.13 57.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.365 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.7 p -67.25 -29.6 46.41 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.221 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.38 -33.86 76.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.1 m -75.94 -36.23 59.43 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.4 -35.1 79.48 Favored 'General case' 0 CA--C 1.527 0.094 0 O-C-N 122.195 -0.315 . . . . 0.0 111.546 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.7 m -79.15 -26.59 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 118.442 0.564 . . . . 0.0 111.02 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 51.9 m -67.13 -35.49 79.85 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -81.01 -25.06 37.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.478 -0.139 . . . . 0.0 110.873 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.83 -43.6 68.22 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 122.189 -0.319 . . . . 0.0 110.229 179.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -74.84 -22.23 58.81 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.177 0.191 . . . . 0.0 110.748 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.37 -34.84 73.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -75.73 -22.89 56.13 Favored 'General case' 0 N--CA 1.457 -0.116 0 O-C-N 122.289 -0.257 . . . . 0.0 110.54 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.0 mm -73.49 -52.52 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.148 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -69.83 -20.5 63.43 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -175.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -72.02 -20.69 61.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -154.06 -37.82 0.1 Allowed 'General case' 0 N--CA 1.458 -0.067 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -173.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 56.4 p . . . . . 0 N--CA 1.467 0.406 0 C-N-CA 126.274 1.83 . . . . 0.0 115.796 -168.186 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 110.882 -0.044 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.1 tpt -54.13 -35.06 61.79 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.18 -37.19 94.11 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.97 -15.6 58.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.36 -0.494 . . . . 0.0 111.254 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.3 -58.11 3.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.629 HD23 ' H ' ' B' ' 32' ' ' LEU . 1.9 pt? -81.51 -13.25 58.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.489 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -69.5 -35.6 75.69 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.582 0.628 . . . . 0.0 109.408 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 36.4 t -66.54 -35.41 80.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.7 -31.76 72.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 110.923 175.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -87.39 -20.86 26.09 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 121.759 -0.588 . . . . 0.0 111.059 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -69.51 -36.03 76.09 Favored 'General case' 0 CA--C 1.526 0.027 0 CA-C-N 118.447 0.567 . . . . 0.0 111.131 -178.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -67.03 -16.69 64.52 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 118.057 0.389 . . . . 0.0 111.115 178.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -79.16 -13.31 59.8 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 110.56 -0.163 . . . . 0.0 110.56 173.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.424 ' C ' ' H ' ' B' ' 42' ' ' GLU . 30.8 mm -102.46 -18.45 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 118.213 0.461 . . . . 0.0 111.052 -178.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -74.88 28.92 0.09 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.596 0.758 . . . . 0.0 110.663 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' B' ' 40' ' ' ILE . 80.6 mm-40 -137.67 177.62 7.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.084 0.954 . . . . 0.0 110.794 -174.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -65.82 179.33 0.88 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.889 0.876 . . . . 0.0 111.489 177.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.42 151.52 74.89 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.074 0.55 . . . . 0.0 110.173 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.07 79.15 3.47 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.091 3.194 . . . . 0.0 110.869 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.43 -3.77 0.49 Allowed 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -61.25 -23.77 65.89 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.766 -0.584 . . . . 0.0 112.179 179.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -69.26 -33.63 73.54 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 118.268 0.485 . . . . 0.0 110.211 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 78.7 mt -83.51 -13.03 55.51 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.89 -0.506 . . . . 0.0 110.561 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -71.12 -23.47 62.1 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.58 -17.89 61.13 Favored 'General case' 0 CA--C 1.523 -0.072 0 C-N-CA 122.741 0.417 . . . . 0.0 110.804 174.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.439 ' C ' ' H ' ' B' ' 54' ' ' LYS . 37.2 mt -90.59 -14.76 31.85 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.317 -0.24 . . . . 0.0 110.889 173.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -72.35 18.54 0.09 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.062 0.945 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.6 pttt -137.14 6.11 2.82 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.472 1.109 . . . . 0.0 110.978 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -149.31 -18.5 0.28 Allowed 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.254 0 CA-C-N 118.314 0.506 . . . . 0.0 112.02 178.893 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 CA--C 1.528 0.102 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.0 tp -54.92 -33.68 62.41 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.909 0.484 . . . . 0.0 111.755 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.49 -23.92 65.31 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.79 -0.569 . . . . 0.0 112.007 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -81.0 -0.4 39.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.427 0.613 . . . . 0.0 111.177 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -134.37 3.56 3.36 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.403 0.681 . . . . 0.0 110.432 -178.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 7' ' ' LEU . 0.8 OUTLIER -106.06 -41.65 5.31 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.873 0.869 . . . . 0.0 108.952 178.05 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.434 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -60.84 -43.5 91.85 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.219 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 74.3 Cg_endo -72.69 -4.46 15.38 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.386 2.057 . . . . 0.0 113.284 -173.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -135.56 12.77 3.47 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.236 0.471 . . . . 0.0 110.801 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -56.03 -41.05 89.02 Favored Pre-proline 0 CA--C 1.537 0.474 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -179.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.49 -8.28 12.62 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 121.954 1.77 . . . . 0.0 112.466 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.92 -21.42 65.99 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.855 0.752 . . . . 0.0 110.834 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 63.4 mt -73.09 -18.98 61.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.795 0.27 . . . . 0.0 110.487 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.9 mtt-85 -97.93 -19.75 17.88 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -53.6 -27.24 25.59 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.88 1.272 . . . . 0.0 111.833 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.8 p90 -140.44 -14.86 0.97 Allowed 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.681 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.5 -29.73 75.93 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -70.77 -3.68 20.01 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.23 1.015 . . . . 0.0 112.037 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.32 6.36 7.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.631 0.772 . . . . 0.0 110.398 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.4 tp -107.96 6.63 27.37 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.293 1.037 . . . . 0.0 110.103 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.8 p -132.87 -19.28 2.31 Favored 'General case' 0 C--O 1.23 0.047 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.28 -2.84 87.39 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-O 119.672 -0.515 . . . . 0.0 112.712 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.6 t -157.92 139.26 13.54 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.214 1.007 . . . . 0.0 110.858 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -65.23 -20.1 66.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.42 -0.175 . . . . 0.0 111.184 178.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -72.99 -34.56 66.49 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 178.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -83.18 -29.02 28.91 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.226 -0.286 . . . . 0.0 110.226 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.52 -40.98 67.05 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.67 -33.67 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 117.434 0.617 . . . . 0.0 110.684 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -69.72 -45.92 67.11 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 119.469 -0.301 . . . . 0.0 111.448 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -67.65 -32.58 73.36 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.453 0.57 . . . . 0.0 111.248 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.6 t -63.94 -50.15 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 CA-C-N 118.173 0.442 . . . . 0.0 110.673 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -75.74 -27.38 58.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.974 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.8 -23.03 59.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.741 -0.171 . . . . 0.0 110.828 176.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.0 m -63.57 -48.0 79.21 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -70.58 -35.26 72.95 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.73 0.3 . . . . 0.0 110.333 -178.157 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -67.12 -16.66 64.46 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.876 -0.515 . . . . 0.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -87.39 -6.88 58.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.956 -0.465 . . . . 0.0 111.281 174.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 36.2 mm -98.36 -27.59 3.68 Favored 'Isoleucine or valine' 0 C--N 1.339 0.122 0 CA-C-N 117.856 0.298 . . . . 0.0 110.682 -179.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.0 m -66.69 -7.09 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -89.81 -15.83 31.48 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 118.077 0.399 . . . . 0.0 110.559 175.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -170.04 89.67 0.53 Allowed Pre-proline 0 CA--C 1.532 0.273 0 C-N-CA 124.199 1.0 . . . . 0.0 109.2 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.48 -5.97 15.35 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.029 2.486 . . . . 0.0 112.219 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.6 -14.51 59.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.497 0.319 . . . . 0.0 110.623 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -83.87 9.35 12.29 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.273 0.629 . . . . 0.0 111.352 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -130.54 79.97 71.13 Favored Pre-proline 0 N--CA 1.451 -0.412 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.43 157.59 61.17 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.303 2.669 . . . . 0.0 111.408 -173.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 7.46 2.77 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.256 1.022 . . . . 0.0 110.493 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.7 9.49 1.8 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.623 1.169 . . . . 0.0 110.835 174.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.2 m -131.77 -172.43 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 C-N-CA 124.509 1.123 . . . . 0.0 109.272 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -58.43 148.98 62.55 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.26 13.19 0.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 124.169 3.246 . . . . 0.0 112.372 -177.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -129.11 -16.95 3.95 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 119.312 -0.375 . . . . 0.0 111.371 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' A' ' 54' ' ' LEU . 18.4 mt -71.56 -39.03 70.91 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.649 0.659 . . . . 0.0 110.479 179.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.2 -39.02 94.34 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -54.3 47.77 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.541 0.736 . . . . 0.0 110.147 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -72.3 -36.29 68.89 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.81 -175.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 52.9 tpt85 -60.77 -41.84 96.31 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.617 0.644 . . . . 0.0 111.394 -174.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.8 mmm -81.38 -26.8 35.19 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.521 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -68.17 -38.0 81.59 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.686 0.676 . . . . 0.0 110.323 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -67.75 -24.79 65.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.47 0.308 . . . . 0.0 110.242 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.22 -37.89 71.81 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -72.25 -40.04 64.97 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 CA-C-N 117.985 0.892 . . . . 0.0 109.999 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -69.14 -35.58 76.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 122.555 -0.091 . . . . 0.0 110.825 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.86 -27.69 65.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 122.387 -0.196 . . . . 0.0 110.689 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.1 t -82.72 -18.14 41.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.286 0.234 . . . . 0.0 110.703 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -46.75 30.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.327 0.251 . . . . 0.0 110.823 -179.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -77.41 -15.89 59.11 Favored 'General case' 0 CA--C 1.527 0.09 0 O-C-N 122.276 -0.265 . . . . 0.0 111.211 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.71 2.03 24.26 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.412 0.685 . . . . 0.0 111.237 176.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -137.75 0.9 2.27 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.089 0.556 . . . . 0.0 111.362 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 87.41 5.94 78.48 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 119.728 -0.484 . . . . 0.0 113.327 175.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.65 -15.41 63.51 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.155 0.978 . . . . 0.0 111.405 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -160.11 153.77 22.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.726 0.81 . . . . 0.0 109.75 177.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -146.33 -9.4 0.5 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.699 0.4 . . . . 0.0 112.046 177.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -165.84 176.85 7.58 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.397 0.679 . . . . 0.0 109.681 -178.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.4 p -152.65 155.91 38.22 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.772 0.429 . . . . 0.0 110.464 177.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -157.26 162.28 39.2 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.8 m -139.0 165.54 26.86 Favored 'General case' 0 C--O 1.23 0.055 0 O-C-N 122.084 -0.385 . . . . 0.0 110.79 -177.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -149.34 25.92 0.87 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.879 0.472 . . . . 0.0 110.994 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.07 164.88 1.47 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.983 0.42 . . . . 0.0 111.307 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.97 -10.65 30.95 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -174.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 157.04 21.74 0.03 OUTLIER Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.255 -0.747 . . . . 0.0 113.437 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.5 t -137.51 6.73 2.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.423 1.111 . . . . 0.0 112.955 -175.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -143.03 -35.89 0.39 Allowed 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.709 0.403 . . . . 0.0 110.043 173.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.44 -27.06 67.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.8 p -66.56 -27.62 40.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 C-N-CA 122.536 0.334 . . . . 0.0 110.422 178.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.66 -0.45 55.17 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.013 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -130.29 -18.52 3.24 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 118.149 0.431 . . . . 0.0 112.087 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.1 -1.82 31.09 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.766 0.426 . . . . 0.0 110.543 174.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.595 ' C ' HD12 ' A' ' 91' ' ' LEU . 99.4 mtt180 -130.24 -13.49 3.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.004 0.522 . . . . 0.0 112.317 -177.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.595 HD12 ' C ' ' A' ' 90' ' ' ARG . 9.9 mp -129.68 15.51 5.92 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.481 0.713 . . . . 0.0 111.611 -172.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.33 9.51 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 177.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 91' ' ' LEU . 66.9 mtt85 -124.6 15.34 8.8 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.545 0.738 . . . . 0.0 110.892 -176.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 39.3 ttm -115.35 142.38 46.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.028 0.931 . . . . 0.0 109.467 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.504 HG23 ' H ' ' A' ' 98' ' ' SER . 5.7 t -68.04 140.42 93.49 Favored Pre-proline 0 CA--C 1.531 0.22 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -53.2 -22.73 20.63 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.968 3.112 . . . . 0.0 114.418 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -79.3 -46.27 18.04 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.031 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.504 ' H ' HG23 ' A' ' 95' ' ' THR . 55.6 m -67.81 -23.54 65.2 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.214 -0.304 . . . . 0.0 111.175 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.0 ttp180 -67.73 -33.32 74.63 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.22 -37.49 61.09 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 177.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.85 76.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 178.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.1 tp -61.78 -50.92 70.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.577 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 3.8 pp -79.44 0.88 27.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 115' ' ' ALA . 14.8 tp -97.29 -6.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.231 -0.293 . . . . 0.0 111.391 177.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.8 p -140.53 -16.78 0.9 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -81.53 -12.89 58.66 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.465 1.03 . . . . 0.0 113.045 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.577 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 1.8 pmm? -154.08 14.9 0.47 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -129.58 -11.99 4.42 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.525 0.602 . . . . 0.0 112.052 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 68.51 7.55 53.57 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-O 118.887 -0.951 . . . . 0.0 114.761 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -58.39 150.34 22.52 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.354 1.577 . . . . 0.0 110.634 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.9 p -71.8 161.28 79.54 Favored Pre-proline 0 N--CA 1.454 -0.269 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.48 -16.49 47.5 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.059 1.84 . . . . 0.0 111.02 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -79.17 -45.05 20.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 117.884 0.311 . . . . 0.0 110.572 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -74.07 -32.0 63.08 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.413 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -69.54 -22.67 63.54 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.239 0.216 . . . . 0.0 110.991 177.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.11 -29.79 34.75 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.516 0.198 . . . . 0.0 110.694 179.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.3 -38.94 82.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.663 0.385 . . . . 0.0 111.333 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 57.0 mt -72.91 -4.06 29.61 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 12.5 pt -135.41 11.64 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 118.986 0.812 . . . . 0.0 111.281 177.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 52.03 59.57 4.44 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.905 1.282 . . . . 0.0 113.827 176.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.03 -178.42 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 123.521 0.728 . . . . 0.0 109.932 176.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -83.28 160.26 21.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 86.2 m -60.49 -37.56 81.49 Favored 'General case' 0 C--O 1.232 0.177 0 O-C-N 121.954 -0.466 . . . . 0.0 110.579 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.9 t -70.5 -24.51 62.86 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 122.364 -0.21 . . . . 0.0 111.029 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -71.68 -37.53 70.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.126 178.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.05 -38.63 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-N 118.401 0.546 . . . . 0.0 109.842 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -58.78 -37.86 77.26 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 110.508 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.7 m -78.05 -38.4 44.54 Favored 'General case' 0 N--CA 1.457 -0.085 0 O-C-N 122.432 -0.167 . . . . 0.0 110.656 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 60.3 mt -64.85 -33.35 75.79 Favored 'General case' 0 N--CA 1.456 -0.139 0 O-C-N 122.082 -0.386 . . . . 0.0 111.672 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.3 m -80.56 -28.68 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 CA-C-N 118.587 0.631 . . . . 0.0 110.521 177.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 89.5 m -68.58 -38.2 80.5 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -76.72 -27.62 55.51 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.267 -0.271 . . . . 0.0 110.888 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.67 -49.85 55.74 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 122.23 -0.294 . . . . 0.0 110.309 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.02 -22.34 62.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.716 -0.183 . . . . 0.0 111.131 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.91 -37.18 64.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.746 0.248 . . . . 0.0 110.726 177.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -74.45 -19.35 60.42 Favored 'General case' 0 N--CA 1.457 -0.079 0 CA-C-N 117.599 0.182 . . . . 0.0 110.544 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 19.2 mm -75.11 -56.39 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.79 -16.64 64.21 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -70.71 -22.29 62.46 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 179.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -157.57 -38.15 0.07 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -173.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 30.3 p . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 124.504 1.121 . . . . 0.0 112.274 -169.483 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.532 0.27 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -60.83 -27.0 67.75 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.302 0.501 . . . . 0.0 111.492 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.35 -33.69 61.32 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.669 -0.973 . . . . 0.0 110.669 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.49 -23.02 37.63 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 117.163 0.482 . . . . 0.0 110.841 179.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.05 -43.02 72.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . 0.422 ' HB2' ' HE2' ' A' ' 107' ' ' MET . 85.2 mt -70.25 -39.34 75.05 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.112 177.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.93 -35.29 78.19 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.053 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.1 t -65.81 -42.94 90.05 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.477 0.581 . . . . 0.0 110.214 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.9 66.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.592 0.357 . . . . 0.0 111.81 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -110.77 -14.89 13.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 62.0 tp60 -68.33 -38.19 81.29 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.74 -24.99 67.74 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.211 0.078 . . . . 0.0 111.211 176.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 39.8 m -72.04 -12.59 61.29 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 47.0 pt -129.1 8.36 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 118.403 0.547 . . . . 0.0 111.92 -178.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.56 24.72 0.56 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.26 0.624 . . . . 0.0 111.536 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -144.77 -178.32 5.96 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.859 -0.526 . . . . 0.0 111.622 -176.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -61.91 175.96 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.583 1.153 . . . . 0.0 111.808 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.2 m -135.33 155.88 78.36 Favored Pre-proline 0 C--O 1.232 0.156 0 C-N-CA 122.924 0.49 . . . . 0.0 111.064 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.2 176.24 2.12 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.844 3.03 . . . . 0.0 112.472 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -148.55 -2.39 0.5 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.389 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -65.29 -24.85 67.41 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.681 0.393 . . . . 0.0 111.483 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 45.2 mtm -76.18 -36.7 58.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.403 0.281 . . . . 0.0 110.956 -179.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 64.2 mt -77.72 -15.58 59.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.616 -0.678 . . . . 0.0 109.736 175.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -71.11 -21.33 62.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.829 -0.545 . . . . 0.0 109.698 173.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.0 mt -71.56 -14.61 62.14 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 173.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' B' ' 54' ' ' LYS . 28.5 mt -89.73 -16.47 30.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.747 0.249 . . . . 0.0 111.48 174.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -71.09 18.35 0.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.415 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.8 pttt -133.91 2.7 3.41 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.31 0.644 . . . . 0.0 111.918 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -153.04 -3.3 0.22 Allowed 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.234 0 CA-C-N 118.751 0.705 . . . . 0.0 112.096 -178.413 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.2 p . . . . . 0 CA--C 1.527 0.093 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.1 tp -85.27 -31.73 22.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 117.997 0.362 . . . . 0.0 111.04 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.83 -30.62 74.54 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -73.11 2.18 7.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.903 0.881 . . . . 0.0 111.269 177.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -130.66 -20.37 2.9 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.461 0.704 . . . . 0.0 111.043 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.53 -32.51 18.15 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.568 0.347 . . . . 0.0 111.313 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.447 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.79 -44.28 96.83 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 72.2 Cg_endo -71.89 -2.32 11.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.098 1.866 . . . . 0.0 112.423 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -135.2 12.73 3.56 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.122 0.569 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.415 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 43.0 tp -57.82 -41.94 92.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.835 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 88.3 Cg_endo -76.67 -10.94 18.61 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.592 1.528 . . . . 0.0 112.275 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -70.78 -21.28 62.52 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-N 118.775 0.716 . . . . 0.0 110.814 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.4 mt -70.79 -28.18 64.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.831 0.287 . . . . 0.0 110.984 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ptm85 -105.04 -13.67 15.67 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 122.243 -0.286 . . . . 0.0 110.728 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -52.68 -25.81 12.02 Favored 'General case' 0 C--N 1.338 0.071 0 C-N-CA 123.911 0.884 . . . . 0.0 110.845 175.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -139.99 -10.1 1.15 Allowed 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 123.102 0.251 . . . . 0.0 111.576 175.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.0 -28.47 63.73 Favored Glycine 0 C--N 1.34 0.76 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 173.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.34 -8.4 39.61 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.199 0.6 . . . . 0.0 111.837 175.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -116.73 0.37 12.56 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.103 0.561 . . . . 0.0 111.622 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -97.61 -3.53 39.36 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.062 0.545 . . . . 0.0 111.379 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -156.59 -5.65 0.11 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.58 26.06 51.77 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 121.891 -0.506 . . . . 0.0 113.778 174.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 t -150.92 127.45 10.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.798 0.799 . . . . 0.0 109.553 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -71.82 -18.66 62.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.112 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -68.32 -42.67 79.04 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -81.17 -31.72 33.92 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 177.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.52 -42.54 93.57 Favored Glycine 0 C--N 1.335 0.515 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -72.51 -30.23 64.3 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 117.595 0.697 . . . . 0.0 110.148 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -71.09 -41.82 70.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.411 -0.328 . . . . 0.0 111.487 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -66.07 -44.21 85.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.412 0.551 . . . . 0.0 111.598 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.7 m -68.52 -34.72 66.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 CA-C-N 118.499 0.59 . . . . 0.0 110.97 -176.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.9 ttp180 -79.45 -32.45 42.68 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.094 -0.379 . . . . 0.0 110.825 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.61 63.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 64.5 m -64.61 -40.38 95.39 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.483 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.4 OUTLIER -77.62 -34.98 53.16 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.73 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -61.67 -24.27 66.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.96 -0.462 . . . . 0.0 110.411 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.15 -16.17 59.24 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.593 0.357 . . . . 0.0 111.04 175.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 20.3 mm -90.57 -18.92 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 58.7 t -64.52 -4.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.277 0.631 . . . . 0.0 110.968 176.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.47 1.68 9.57 Favored 'General case' 0 C--N 1.34 0.177 0 O-C-N 121.697 -0.627 . . . . 0.0 111.195 178.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -158.16 54.35 0.74 Allowed Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 123.239 0.616 . . . . 0.0 111.094 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -72.08 -3.71 13.79 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.981 3.121 . . . . 0.0 112.034 -176.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -106.01 12.59 30.3 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.268 0.627 . . . . 0.0 112.131 -175.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -138.67 7.92 2.56 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -56.15 132.13 74.88 Favored Pre-proline 0 CA--C 1.531 0.237 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -69.97 120.94 7.6 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.346 2.697 . . . . 0.0 112.038 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.4 mmm180 -142.14 6.17 1.73 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.96 1.304 . . . . 0.0 110.205 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -82.53 13.3 3.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.117 0.967 . . . . 0.0 111.068 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.65 -166.73 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 125.03 1.332 . . . . 0.0 108.654 -177.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.54 144.09 18.35 Favored Pre-proline 0 N--CA 1.455 -0.195 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -65.87 2.02 1.96 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.899 2.399 . . . . 0.0 112.259 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -121.64 -18.35 7.19 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 123.616 0.766 . . . . 0.0 111.162 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -74.34 -31.21 62.34 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.262 0.483 . . . . 0.0 110.325 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.46 -33.99 68.05 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.74 -44.54 95.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -80.5 -19.87 44.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.315 -0.374 . . . . 0.0 111.782 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 24.3 tpt180 -70.48 -47.31 61.17 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.643 0.656 . . . . 0.0 110.548 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -71.34 -33.7 69.84 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.098 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -66.72 -39.85 88.16 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.288 -0.258 . . . . 0.0 111.314 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -68.41 -24.72 64.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.75 -37.57 84.48 Favored Glycine 0 C--N 1.339 0.717 0 N-CA-C 111.394 -0.683 . . . . 0.0 111.394 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.2 mm -73.48 -41.6 56.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.127 0 CA-C-N 117.84 0.82 . . . . 0.0 110.166 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.4 t90 -67.54 -38.17 83.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.713 0.233 . . . . 0.0 110.934 -176.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.05 -29.0 62.65 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.241 -0.287 . . . . 0.0 111.108 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 40.2 t -80.08 -30.68 39.27 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 117.539 0.154 . . . . 0.0 110.938 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.77 -31.0 59.33 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.411 -0.181 . . . . 0.0 111.182 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -85.33 -12.45 52.23 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 122.172 -0.33 . . . . 0.0 111.335 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.23 0.03 26.74 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -140.34 4.51 2.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.665 0.386 . . . . 0.0 111.362 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.13 6.21 88.33 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.941 -0.366 . . . . 0.0 112.809 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -75.59 5.14 6.41 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 117.664 0.732 . . . . 0.0 111.807 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -150.78 172.2 15.98 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.077 0.465 . . . . 0.0 111.131 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -146.66 -167.13 2.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.06 1.344 . . . . 0.0 108.729 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 10.4 t -138.9 164.17 30.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.993 0.517 . . . . 0.0 110.03 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.0 t -158.43 -172.72 3.97 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.398 0.679 . . . . 0.0 109.774 -176.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -148.58 8.55 0.79 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.5 m -146.14 142.13 28.18 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.896 0.771 . . . . 0.0 111.499 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -154.13 10.91 0.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.313 1.045 . . . . 0.0 110.403 175.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -153.81 -174.89 5.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.622 0.769 . . . . 0.0 109.582 -176.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -126.17 11.25 7.56 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.106 0.562 . . . . 0.0 110.764 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -166.18 9.71 0.06 OUTLIER Glycine 0 CA--C 1.527 0.843 0 CA-C-O 119.23 -0.761 . . . . 0.0 112.653 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.2 p -139.68 -7.58 1.27 Allowed 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.567 1.184 . . . . 0.0 112.917 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -137.93 -39.18 0.56 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.75 -25.41 67.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.9 p -66.66 -31.02 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 C-N-CA 122.542 0.337 . . . . 0.0 110.565 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.2 -1.08 52.13 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.223 0.609 . . . . 0.0 111.568 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -130.55 -15.07 3.61 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.49 0.316 . . . . 0.0 111.698 177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.92 -1.93 18.84 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.871 0.468 . . . . 0.0 110.468 174.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.556 ' C ' HD22 ' A' ' 91' ' ' LEU . 90.8 mtt-85 -129.25 -15.64 4.11 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.994 0.518 . . . . 0.0 111.536 178.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.556 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.5 mm? -138.02 36.44 2.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.114 0.966 . . . . 0.0 110.59 -172.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.88 7.77 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 82.3 mmt-85 -130.68 4.35 4.59 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.062 0.846 . . . . 0.0 112.361 -177.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 57.2 ttm -65.79 143.69 57.34 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.369 0.531 . . . . 0.0 111.168 -178.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 m -61.37 139.12 94.82 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.926 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -66.62 5.45 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 124.246 3.297 . . . . 0.0 113.564 -177.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.97 -35.03 2.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.5 m -62.42 -19.65 63.69 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.0 -0.437 . . . . 0.0 109.86 171.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -58.26 -41.34 84.06 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.664 0.786 . . . . 0.0 110.72 174.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -77.47 -38.49 49.17 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.73 74.43 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 122.243 -0.286 . . . . 0.0 110.825 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -66.56 -48.65 68.97 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.3 mt -67.93 -14.95 63.37 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.882 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.0 mt -98.72 -4.82 32.73 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.911 0.484 . . . . 0.0 111.909 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -136.27 10.24 3.24 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.99 4.94 2.31 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.9 mtm -140.8 -5.02 1.18 Allowed 'General case' 0 C--N 1.339 0.109 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -150.25 -5.88 0.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.382 0.992 . . . . 0.0 112.987 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.95 25.25 65.77 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-O 119.009 -0.884 . . . . 0.0 113.828 175.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -55.38 150.16 11.99 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.641 1.22 . . . . 0.0 110.08 177.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 69.7 m -68.39 153.26 95.86 Favored Pre-proline 0 CA--C 1.529 0.172 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.78 -28.62 39.09 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 123.188 2.592 . . . . 0.0 112.807 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -72.84 -32.82 65.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.23 -0.293 . . . . 0.0 110.772 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -83.52 -36.01 24.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 122.367 -0.208 . . . . 0.0 110.499 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.02 70.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 122.396 -0.19 . . . . 0.0 110.99 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.55 -28.58 33.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.66 0.384 . . . . 0.0 111.252 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -71.34 -27.62 63.5 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.651 0.78 . . . . 0.0 111.59 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.9 mt -85.78 -0.16 54.53 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . 0.438 HG13 HG22 ' A' ' 121' ' ' VAL . 20.0 pt -135.42 9.86 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 118.509 0.595 . . . . 0.0 111.575 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 55.34 53.92 9.31 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.498 1.119 . . . . 0.0 113.87 175.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.438 HG22 HG13 ' A' ' 119' ' ' ILE . 23.3 m -134.79 174.94 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 C-N-CA 122.895 0.478 . . . . 0.0 110.023 174.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -76.29 158.37 31.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 37.2 m -59.87 -36.61 77.28 Favored 'General case' 0 C--N 1.334 -0.098 0 O-C-N 122.109 -0.37 . . . . 0.0 111.149 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 93.4 p -76.88 -20.92 55.7 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 121.79 -0.569 . . . . 0.0 111.1 -178.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.0 -44.02 55.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.059 178.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.07 -31.23 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.238 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -62.4 -35.32 78.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.707 0.23 . . . . 0.0 110.408 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.6 m -75.63 -36.65 60.16 Favored 'General case' 0 N--CA 1.457 -0.097 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 178.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.1 mp -67.37 -36.58 81.65 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 119.263 -0.399 . . . . 0.0 111.191 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.9 m -76.47 -26.09 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.128 0 CA-C-N 118.937 0.789 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 82.5 m -66.59 -35.79 81.06 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -80.85 -26.77 36.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.364 -0.21 . . . . 0.0 110.623 177.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.53 73.1 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.43 -0.169 . . . . 0.0 110.63 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -78.18 -22.33 48.78 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.916 -0.49 . . . . 0.0 110.333 177.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.82 -38.71 70.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.214 -0.304 . . . . 0.0 110.466 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -78.85 -18.83 53.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.349 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 5.6 mm -63.68 -51.16 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.12 -17.04 61.44 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -71.89 -17.67 62.1 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -149.82 -41.98 0.14 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 N--CA 1.469 0.484 0 N-CA-C 117.367 2.358 . . . . 0.0 117.367 -175.297 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 . . . . . 0 CA--C 1.531 0.228 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.3 tpt -62.14 -28.7 69.83 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.108 0.413 . . . . 0.0 110.359 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.98 62.89 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -17.44 62.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.157 0.479 . . . . 0.0 111.103 178.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.98 -41.69 20.4 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 20.0 mt -70.82 -37.76 73.24 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.64 -29.14 69.1 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.357 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t -67.29 -40.39 86.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.746 0.703 . . . . 0.0 110.277 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.75 -24.23 64.42 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -105.55 -12.49 15.94 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -72.38 -37.99 68.59 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -65.33 -21.86 66.75 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.804 -0.141 . . . . 0.0 110.789 177.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 60.8 m -73.89 -13.23 60.88 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 117.628 0.195 . . . . 0.0 111.282 174.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 63.6 mt -98.26 -23.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 O-C-N 121.933 -0.479 . . . . 0.0 109.934 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.78 27.2 0.18 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.757 0.823 . . . . 0.0 112.103 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -139.57 175.9 9.18 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -64.68 177.62 0.9 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.193 0.997 . . . . 0.0 112.023 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.11 154.28 77.32 Favored Pre-proline 0 C--O 1.233 0.23 0 C-N-CA 123.774 0.829 . . . . 0.0 109.794 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -76.25 -26.59 8.85 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.912 2.408 . . . . 0.0 113.341 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p30 45.15 0.98 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.254 2.222 . . . . 0.0 116.599 -177.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.78 -17.06 64.68 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.243 0.929 . . . . 0.0 111.534 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 17.9 mtm -68.33 -42.03 79.93 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.87 -16.32 57.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -67.71 -21.79 65.29 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.834 -0.541 . . . . 0.0 109.819 173.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.73 -28.86 65.04 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 173.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.96 -14.33 60.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 121.266 -0.174 . . . . 0.0 111.442 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -67.68 -1.05 4.6 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.123 0.42 . . . . 0.0 110.34 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -96.27 -10.15 28.61 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.207 0.603 . . . . 0.0 112.164 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -156.28 -1.1 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.181 0 CA-C-N 119.062 0.846 . . . . 0.0 112.74 -178.435 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 t . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.51 -37.49 85.16 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.389 -0.819 . . . . 0.0 110.817 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.19 -28.24 71.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -77.94 1.49 20.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.414 0.686 . . . . 0.0 111.443 179.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -130.2 -3.66 4.43 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.235 0.614 . . . . 0.0 111.71 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.4 mt -111.19 -25.71 9.57 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.519 -0.277 . . . . 0.0 111.157 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.429 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -64.0 -43.96 76.65 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 98.5 Cg_endo -74.4 -1.37 10.92 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.52 2.147 . . . . 0.0 113.156 -175.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -134.99 12.26 3.61 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.929 0.492 . . . . 0.0 110.637 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.418 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 43.1 tp -64.47 -39.54 42.36 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 124.847 1.259 . . . . 0.0 114.207 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 90.6 Cg_endo -77.9 -26.22 6.9 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 CA-C-N 120.666 1.274 . . . . 0.0 112.436 -172.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -51.52 -38.34 53.69 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.606 0.639 . . . . 0.0 111.981 -173.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.7 mt -67.54 -19.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -112.56 -32.55 6.43 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -73.98 -6.96 50.53 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.268 0.227 . . . . 0.0 111.235 -177.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -136.8 -13.35 1.69 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.728 0.411 . . . . 0.0 110.785 167.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -57.45 -33.57 66.61 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -59.86 -24.2 64.04 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 117.931 0.865 . . . . 0.0 111.848 177.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.76 0.94 57.46 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.254 0.622 . . . . 0.0 110.654 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -120.86 4.83 10.49 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.508 1.123 . . . . 0.0 110.474 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.9 p -139.22 -15.04 1.12 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.65 -2.99 87.64 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.456 -0.635 . . . . 0.0 113.146 177.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.6 t -159.95 136.06 8.71 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.243 1.022 . . . . 0.0 111.099 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -66.2 -19.09 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.37 -0.206 . . . . 0.0 111.344 175.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -75.34 -28.31 59.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 117.92 0.327 . . . . 0.0 110.198 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -78.11 -37.25 46.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.21 -29.99 75.05 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -69.55 -41.74 75.5 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.244 0.522 . . . . 0.0 110.887 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.29 -24.03 27.89 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 118.906 -0.569 . . . . 0.0 112.27 -175.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -72.77 -36.34 67.63 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 119.309 0.959 . . . . 0.0 109.925 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.6 t -64.89 -43.17 96.33 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 CA-C-N 117.856 0.298 . . . . 0.0 110.618 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -77.31 -28.39 53.22 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 121.279 -0.169 . . . . 0.0 111.266 -178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.48 -27.68 58.92 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.228 0.211 . . . . 0.0 110.589 175.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 53.0 m -63.95 -39.24 93.69 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.73 -45.9 56.32 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -58.31 -30.25 66.53 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.79 0.436 . . . . 0.0 111.773 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.56 0.45 22.96 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.794 0.438 . . . . 0.0 111.918 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.411 HD13 ' CD2' ' A' ' 46' ' ' PHE . 73.1 mt -124.72 -13.9 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 C-N-CA 123.909 0.884 . . . . 0.0 110.177 -177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.0 t -61.48 -14.45 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.312 0.645 . . . . 0.0 111.09 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.76 5.6 9.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.582 0.753 . . . . 0.0 110.562 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.83 51.75 0.77 Allowed Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 123.335 0.654 . . . . 0.0 111.51 -175.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.46 -8.01 19.5 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.176 2.584 . . . . 0.0 111.856 -178.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -82.1 3.37 27.22 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.956 0.902 . . . . 0.0 110.734 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -114.29 9.07 16.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.052 0.541 . . . . 0.0 111.316 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.411 ' CD2' HD13 ' A' ' 39' ' ' ILE . 1.0 OUTLIER -129.59 64.5 71.86 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 122.285 0.234 . . . . 0.0 110.489 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.91 170.5 15.4 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.923 3.082 . . . . 0.0 111.334 -178.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.417 ' C ' ' H ' ' A' ' 50' ' ' VAL . 31.1 mmm180 -125.62 12.8 8.04 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.934 0.894 . . . . 0.0 110.589 -177.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -73.35 18.78 0.11 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.47 1.108 . . . . 0.0 111.337 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.417 ' H ' ' C ' ' A' ' 48' ' ' ARG . 27.8 m -136.73 178.6 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 124.7 1.2 . . . . 0.0 109.511 -176.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -54.55 149.4 21.32 Favored Pre-proline 0 C--O 1.233 0.209 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.3 5.93 1.7 Allowed 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.144 2.562 . . . . 0.0 111.953 -176.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -128.16 -24.06 3.2 Favored 'General case' 0 C--O 1.228 -0.033 0 C-N-CA 123.764 0.825 . . . . 0.0 111.35 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.9 tp -66.99 -32.41 73.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.333 0.515 . . . . 0.0 110.287 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -72.91 -34.78 58.69 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.51 -43.22 90.78 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -73.97 -34.5 64.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.475 0.176 . . . . 0.0 111.475 -177.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 48.3 tpt85 -72.47 -37.43 68.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -174.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.0 mmm -76.8 -31.98 57.34 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.18 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -67.09 -35.03 78.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 174.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -64.46 -31.03 72.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.531 0.332 . . . . 0.0 110.236 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.02 -43.84 90.0 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.6 mm -72.98 -39.07 57.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 117.353 0.577 . . . . 0.0 110.099 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -68.25 -41.65 80.83 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.41 -0.181 . . . . 0.0 111.132 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.91 -32.64 74.03 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.186 0.448 . . . . 0.0 110.648 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.1 t -70.12 -25.94 63.72 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 117.515 0.143 . . . . 0.0 110.663 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.59 -36.02 17.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.493 0.317 . . . . 0.0 111.668 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.5 -15.81 61.79 Favored 'General case' 0 C--O 1.226 -0.14 0 O-C-N 121.973 -0.454 . . . . 0.0 110.522 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.96 7.6 8.64 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 111.471 177.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -130.79 -5.24 4.05 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.45 -9.9 3.49 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 114.747 0.659 . . . . 0.0 114.747 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -72.84 6.3 2.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.369 1.084 . . . . 0.0 112.489 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.1 24.0 0.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.516 1.126 . . . . 0.0 112.749 -174.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -154.1 168.61 25.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.253 0.621 . . . . 0.0 110.392 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.7 t 43.58 39.83 2.55 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.269 1.427 . . . . 0.0 112.47 -179.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.1 p -132.17 9.52 4.45 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.44 -14.47 61.26 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 85.8 p -163.72 166.32 22.26 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.798 -0.564 . . . . 0.0 111.969 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -146.1 23.19 1.36 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.091 0.957 . . . . 0.0 110.547 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -142.96 -179.35 6.31 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.109 0.564 . . . . 0.0 110.504 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -136.92 14.76 3.09 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.941 0.497 . . . . 0.0 111.51 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.44 -0.61 0.23 Allowed Glycine 0 CA--C 1.527 0.832 0 CA-C-O 119.516 -0.602 . . . . 0.0 114.061 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -152.2 8.56 0.48 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.386 1.093 . . . . 0.0 112.198 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -139.01 -28.98 0.78 Allowed 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.067 0.547 . . . . 0.0 109.99 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.29 67.69 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 174.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 10.5 p -67.03 -28.87 44.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-O 120.696 0.284 . . . . 0.0 110.318 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 0.74 51.78 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.34 0.656 . . . . 0.0 111.89 -177.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.89 -17.83 3.1 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-N 118.121 0.419 . . . . 0.0 111.815 176.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.14 -1.79 24.75 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.586 0.355 . . . . 0.0 110.679 174.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.538 ' O ' HD12 ' A' ' 91' ' ' LEU . 94.7 mtt-85 -128.58 -12.22 4.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.621 0.768 . . . . 0.0 111.564 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 90' ' ' ARG . 10.0 mp -131.15 24.11 4.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.5 1.12 . . . . 0.0 109.856 -174.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.0 7.26 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.384 1.474 . . . . 0.0 114.826 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -130.32 -0.15 4.55 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.879 0.763 . . . . 0.0 111.677 -177.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.3 ttm -67.09 147.67 52.86 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 122.079 -0.388 . . . . 0.0 110.514 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 32.1 m -65.85 140.74 97.36 Favored Pre-proline 0 CA--C 1.531 0.236 0 C-N-CA 123.444 0.698 . . . . 0.0 110.594 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 65.9 Cg_exo -53.63 2.89 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.474 1 C-N-CA 125.475 4.117 . . . . 0.0 116.313 177.3 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.2 tp -133.18 -20.03 2.17 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 119.056 0.844 . . . . 0.0 111.586 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.9 m -70.2 -19.4 63.17 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 122.051 -0.405 . . . . 0.0 110.919 176.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -65.47 -45.21 84.59 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.437 0.295 . . . . 0.0 110.973 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.401 ' H ' ' HG2' ' A' ' 100' ' ' GLN . 16.3 pt20 -83.26 -25.8 31.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.991 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.62 79.42 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.366 0.53 . . . . 0.0 109.785 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 tp -67.74 -37.59 82.38 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.994 0.518 . . . . 0.0 109.91 177.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 57.3 tp -66.27 -21.34 66.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 122.562 0.345 . . . . 0.0 110.729 177.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.44 HD12 ' HB2' ' A' ' 115' ' ' ALA . 0.2 OUTLIER -90.96 -14.98 30.52 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.207 0.603 . . . . 0.0 111.778 -177.38 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.9 p -134.49 4.86 3.42 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -173.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -123.68 -6.98 7.99 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 118.532 0.605 . . . . 0.0 110.771 174.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 21.7 mtm -143.25 0.6 1.18 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -175.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -135.48 -19.96 1.62 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.157 0.435 . . . . 0.0 111.786 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 59.97 17.41 43.8 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 119.118 -0.823 . . . . 0.0 114.501 172.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . 0.415 ' HB2' ' CD1' ' A' ' 104' ' ' LEU . 16.7 m-30 -68.67 162.32 26.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.119 1.46 . . . . 0.0 109.716 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 41.4 t -66.1 145.91 99.01 Favored Pre-proline 0 N--CA 1.456 -0.155 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 175.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.27 -20.39 14.76 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 122.893 2.395 . . . . 0.0 112.656 174.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.2 -31.13 65.6 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 122.44 0.296 . . . . 0.0 111.05 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -80.78 -36.31 31.98 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.44 ' HB2' HD12 ' A' ' 104' ' ' LEU . . . -66.23 -32.93 74.65 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.662 0.385 . . . . 0.0 110.517 175.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -72.46 -32.45 66.27 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 122.33 0.252 . . . . 0.0 110.823 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -73.76 -22.9 59.7 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 110.758 176.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 28.2 tp -84.26 -9.95 58.07 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -177.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.7 pt -135.25 11.75 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.386 0.539 . . . . 0.0 111.351 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 53.52 59.56 4.27 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.65 1.18 . . . . 0.0 113.96 176.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.4 m -137.77 -179.83 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 C-N-CA 123.683 0.793 . . . . 0.0 109.67 175.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -79.58 156.31 27.76 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.5 m -59.17 -37.27 76.96 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 122.141 -0.349 . . . . 0.0 110.77 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.3 t -72.58 -24.49 61.11 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.316 0.247 . . . . 0.0 111.38 -177.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -69.45 -39.76 77.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.726 -0.609 . . . . 0.0 109.794 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.1 t -64.25 -40.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.107 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -58.73 -37.13 75.51 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 122.929 0.143 . . . . 0.0 110.618 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.9 m -77.86 -38.79 45.28 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.2 mt -64.85 -36.06 83.12 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -177.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 32.2 m -82.86 -28.92 8.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.111 0 CA-C-N 118.343 0.52 . . . . 0.0 111.184 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 54.6 m -68.76 -38.98 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 117.843 0.292 . . . . 0.0 110.224 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -75.79 -27.63 58.05 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.597 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.57 -52.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.356 -0.215 . . . . 0.0 110.88 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -71.19 -22.35 62.04 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.41 78.63 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 175.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -74.94 -18.65 60.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.57 -0.252 . . . . 0.0 110.837 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 21.9 mm -74.93 -55.54 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 CA-C-N 118.371 0.532 . . . . 0.0 109.902 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -19.68 65.79 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.071 0.396 . . . . 0.0 111.793 -176.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.5 -22.07 62.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -162.98 -32.32 0.04 OUTLIER 'General case' 0 C--N 1.34 0.192 0 N-CA-C 115.278 1.585 . . . . 0.0 115.278 -170.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.468 0.431 0 C-N-CA 123.968 0.907 . . . . 0.0 112.163 -170.355 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 . . . . . 0 N--CA 1.456 -0.137 0 CA-C-O 119.693 -0.194 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -66.41 -29.02 69.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.384 0.538 . . . . 0.0 111.207 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.51 -34.74 79.83 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.89 -21.57 65.14 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 122.297 -0.531 . . . . 0.0 110.939 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.88 -36.29 21.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.92 0.391 . . . . 0.0 110.322 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -72.99 -45.82 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.869 0.468 . . . . 0.0 110.733 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.1 tpp85 -73.0 -27.4 61.76 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.002 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 46.8 t -66.52 -36.14 81.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.692 0.678 . . . . 0.0 110.311 177.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.26 -30.05 66.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.125 0.17 . . . . 0.0 110.965 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -91.29 -25.45 19.44 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 122.045 -0.41 . . . . 0.0 111.686 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -69.19 -37.47 78.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.668 0.667 . . . . 0.0 110.988 -178.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -63.22 -20.19 65.21 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 118.213 0.461 . . . . 0.0 110.677 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 9.4 m -86.72 -3.26 59.03 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.652 0.781 . . . . 0.0 111.207 175.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 81.4 mt -119.9 -8.5 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.619 -0.676 . . . . 0.0 111.366 -175.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -70.32 28.38 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.875 0.87 . . . . 0.0 112.122 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.1 179.2 7.04 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.571 -0.706 . . . . 0.0 111.371 -178.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -59.53 178.02 0.17 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.428 1.091 . . . . 0.0 113.543 -176.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -133.7 158.47 75.44 Favored Pre-proline 0 C--O 1.234 0.244 0 C-N-CA 124.175 0.99 . . . . 0.0 109.725 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -75.11 -179.82 5.39 Favored 'Trans proline' 0 N--CA 1.451 -1.018 0 C-N-CA 122.818 2.345 . . . . 0.0 110.357 176.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -148.43 -2.34 0.51 Allowed 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 177.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -66.15 -21.69 66.34 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 121.69 -0.631 . . . . 0.0 111.945 -177.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -67.09 -45.61 76.76 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.455 ' N ' HD22 ' B' ' 49' ' ' LEU . 3.2 mm? -75.98 -20.25 58.04 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.86 -21.4 66.46 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 122.323 -0.236 . . . . 0.0 110.534 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 64.6 mt -71.09 -26.43 63.05 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.329 -0.232 . . . . 0.0 110.44 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.49 ' C ' ' H ' ' B' ' 54' ' ' LYS . 48.6 mt -74.08 -17.28 60.97 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.954 178.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -69.04 17.94 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.065 0.393 . . . . 0.0 111.324 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.49 ' H ' ' C ' ' B' ' 52' ' ' LEU . 51.9 mtmt -118.47 -2.39 11.06 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.192 0.997 . . . . 0.0 110.931 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -153.83 -14.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.177 0 CA-C-N 118.353 0.524 . . . . 0.0 111.457 177.338 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t 59.26 170.29 0.07 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.609 1.164 . . . . 0.0 113.215 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp -72.33 -24.79 61.36 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.983 0.913 . . . . 0.0 111.525 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -61.57 -32.03 79.86 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.683 -0.636 . . . . 0.0 112.503 -175.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -75.49 1.44 14.15 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 117.74 0.77 . . . . 0.0 111.852 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -134.09 4.97 3.54 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.559 0.744 . . . . 0.0 110.169 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -111.87 -46.89 3.19 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.813 0.845 . . . . 0.0 109.546 177.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.441 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -60.37 -43.74 93.98 Favored Pre-proline 0 CA--C 1.536 0.442 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -177.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.441 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 75.0 Cg_endo -73.06 -1.49 10.61 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.049 1.832 . . . . 0.0 112.495 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -135.03 7.79 3.45 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.02 0.528 . . . . 0.0 110.524 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.417 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 46.4 tp -57.92 -45.15 99.81 Favored Pre-proline 0 N--CA 1.451 -0.397 0 C-N-CA 124.354 1.061 . . . . 0.0 112.904 -178.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 89.2 Cg_endo -77.84 -10.18 16.88 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 121.935 1.757 . . . . 0.0 112.624 -179.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -65.71 -20.13 66.17 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 118.953 0.797 . . . . 0.0 111.429 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.1 mt -75.97 -19.09 59.02 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 117.72 0.236 . . . . 0.0 110.88 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.28 -18.07 15.63 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.464 0.706 . . . . 0.0 109.666 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.07 -18.74 26.77 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 125.115 1.366 . . . . 0.0 111.231 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 45.0 p90 -140.39 -14.05 1.0 Allowed 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.884 0.327 . . . . 0.0 111.884 172.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.65 -28.22 71.13 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 175.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.21 -10.01 13.65 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.397 0.679 . . . . 0.0 111.812 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -130.21 6.31 4.92 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.367 0.667 . . . . 0.0 111.473 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.8 tp -106.22 -3.91 20.78 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.047 0.539 . . . . 0.0 110.342 178.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.7 t -147.84 -19.92 0.36 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.022 0.529 . . . . 0.0 111.439 174.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.95 22.81 78.67 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-O 119.566 -0.574 . . . . 0.0 113.849 172.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.8 t -146.06 134.77 22.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 118.227 1.014 . . . . 0.0 110.204 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -72.14 -26.49 62.12 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.71 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -73.43 -34.04 65.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -77.05 -39.76 48.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 177.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.23 -36.61 92.0 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -72.02 -36.5 69.69 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.667 0.734 . . . . 0.0 111.246 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -22.91 36.57 Favored 'General case' 0 C--N 1.34 0.156 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.403 -178.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -71.94 -44.49 63.52 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-N 118.709 0.686 . . . . 0.0 110.357 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.36 -34.69 70.42 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 CA-C-N 118.549 0.613 . . . . 0.0 110.967 -178.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -78.54 -32.08 47.77 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 121.019 -0.273 . . . . 0.0 110.937 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.76 -26.71 60.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 175.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 67.4 m -67.01 -37.57 84.41 Favored 'General case' 0 N--CA 1.458 -0.073 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.76 -43.92 44.23 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -62.67 -25.55 68.2 Favored 'General case' 0 N--CA 1.454 -0.261 0 O-C-N 121.96 -0.463 . . . . 0.0 110.571 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.28 0.19 23.05 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.223 0.609 . . . . 0.0 111.648 177.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.03 -14.31 7.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.41 0.684 . . . . 0.0 109.99 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 38.2 t -58.3 -14.56 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 C-N-CA 123.452 0.701 . . . . 0.0 111.527 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -123.06 2.28 9.28 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.053 0.541 . . . . 0.0 111.53 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.83 54.56 1.05 Allowed Pre-proline 0 CA--C 1.533 0.304 0 C-N-CA 123.008 0.523 . . . . 0.0 111.28 -177.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.08 -10.99 27.74 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.886 2.391 . . . . 0.0 112.479 -177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.97 -9.64 58.83 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 122.773 0.429 . . . . 0.0 110.906 176.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -96.93 7.21 47.14 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 123.4 0.68 . . . . 0.0 111.037 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -129.8 60.63 53.04 Favored Pre-proline 0 CA--C 1.533 0.293 0 C-N-CA 122.666 0.386 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.429 ' C ' ' HD3' ' A' ' 48' ' ' ARG . 92.3 Cg_endo -73.7 163.39 37.41 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 123.785 2.99 . . . . 0.0 111.109 178.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.429 ' HD3' ' C ' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -138.34 3.83 2.39 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 123.417 0.687 . . . . 0.0 111.072 179.432 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -70.45 -17.91 63.0 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 m -73.05 -49.14 40.83 Favored 'Isoleucine or valine' 0 C--N 1.34 0.159 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -164.59 152.3 10.39 Favored Pre-proline 0 N--CA 1.453 -0.287 0 C-N-CA 126.545 1.938 . . . . 0.0 107.127 172.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.9 3.15 4.08 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 123.472 2.781 . . . . 0.0 112.449 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -136.0 -21.25 1.44 Allowed 'General case' 0 C--N 1.341 0.21 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -176.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.6 tp -68.76 -29.52 67.93 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.39 0.541 . . . . 0.0 110.989 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -79.29 -34.02 33.92 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.52 -42.45 92.28 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 117.114 0.457 . . . . 0.0 110.185 177.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -77.0 -31.8 56.74 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.22 -37.86 86.55 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.989 0.359 . . . . 0.0 111.634 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.2 mmm -80.52 -34.76 35.37 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.78 -0.368 . . . . 0.0 111.314 -177.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -67.38 -42.43 83.38 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.322 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -72.49 -20.18 61.41 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.434 -0.506 . . . . 0.0 110.584 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.08 -40.36 95.06 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -70.89 -39.0 74.8 Favored 'Isoleucine or valine' 0 C--N 1.338 0.084 0 CA-C-N 117.447 0.624 . . . . 0.0 109.599 177.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -66.93 -40.17 87.52 Favored 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.99 -23.55 62.21 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.415 0.286 . . . . 0.0 111.192 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.4 t -84.14 -20.18 32.91 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.16 0.184 . . . . 0.0 110.633 177.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.66 -49.14 13.68 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 122.379 -0.201 . . . . 0.0 111.385 -178.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.7 p30 -75.2 -13.05 60.42 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.188 -0.32 . . . . 0.0 111.453 -179.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.19 3.21 40.25 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.314 0.646 . . . . 0.0 111.517 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -139.61 3.36 2.08 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.95 0.5 . . . . 0.0 111.359 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.13 4.66 83.94 Favored Glycine 0 CA--C 1.526 0.721 0 C-N-CA 122.978 0.323 . . . . 0.0 112.823 177.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.48 1.85 18.02 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 117.499 0.65 . . . . 0.0 111.277 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -153.75 170.23 21.42 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.025 0.53 . . . . 0.0 110.608 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -145.6 -176.76 5.25 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.352 1.061 . . . . 0.0 109.084 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -56.62 155.72 7.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.919 0.488 . . . . 0.0 111.137 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.0 p -70.82 168.47 16.69 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.584 0.707 . . . . 0.0 111.895 -177.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -156.15 -166.85 2.28 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.309 1.043 . . . . 0.0 108.854 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 72.6 p -145.18 168.43 20.41 Favored 'General case' 0 N--CA 1.457 -0.08 0 C-N-CA 122.564 0.346 . . . . 0.0 110.98 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -143.06 20.27 1.94 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.256 0.622 . . . . 0.0 111.304 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -130.87 -166.27 1.67 Allowed 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 123.769 0.828 . . . . 0.0 109.882 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -142.39 11.41 1.91 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.75 16.01 0.06 OUTLIER Glycine 0 CA--C 1.53 0.973 0 C-N-CA 120.154 -1.022 . . . . 0.0 115.513 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.8 t -147.4 -3.04 0.56 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 119.173 1.487 . . . . 0.0 113.181 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.49 -31.34 0.11 Allowed 'General case' 0 C--N 1.334 -0.079 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -71.95 -20.17 61.78 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 171.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.3 p -70.24 -29.53 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.04 0.54 55.05 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 123.646 0.778 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -115.54 -49.02 2.76 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 124.164 0.986 . . . . 0.0 109.937 179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.46 -2.17 6.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 112.462 -175.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 64.2 mtt-85 -128.77 -7.62 5.04 Favored 'General case' 0 C--N 1.339 0.126 0 C-N-CA 123.171 0.588 . . . . 0.0 111.77 -177.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 mt -140.3 21.99 2.39 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.182 0.593 . . . . 0.0 111.394 -173.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.4 7.63 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.896 1.278 . . . . 0.0 114.078 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -130.2 -3.43 4.45 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 118.772 0.715 . . . . 0.0 112.649 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 53.4 ttm -73.79 142.65 46.19 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.493 HG23 ' H ' ' A' ' 98' ' ' SER . 12.4 t -61.89 147.35 89.86 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.38 -177.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.59 1.2 0.06 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 125.217 3.945 . . . . 0.0 117.016 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 25.7 tp -129.19 -26.58 2.57 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.673 1.124 . . . . 0.0 112.739 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.493 ' H ' HG23 ' A' ' 95' ' ' THR . 73.9 m -68.89 -24.02 64.27 Favored 'General case' 0 C--N 1.337 0.062 0 CA-C-N 119.12 0.873 . . . . 0.0 109.751 175.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -72.66 -25.33 61.23 Favored 'General case' 0 C--N 1.337 0.059 0 C-N-CA 122.183 0.193 . . . . 0.0 110.758 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -80.82 -37.41 30.16 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 176.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.81 -29.96 70.51 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 176.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.22 -48.41 67.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.502 0.321 . . . . 0.0 110.445 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.411 HD12 ' C ' ' A' ' 103' ' ' LEU . 4.2 pp -73.83 -4.72 36.57 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.185 -0.322 . . . . 0.0 111.444 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 25.2 tp -103.05 -7.31 21.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.214 0.606 . . . . 0.0 112.22 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 82.5 p -140.63 2.05 1.77 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.5 8.51 5.0 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.807 0.443 . . . . 0.0 110.688 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 5.0 mtm -143.21 -2.7 0.98 Allowed 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.624 0.77 . . . . 0.0 112.338 -178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.3 tp10 -139.95 -14.69 1.04 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.471 0.578 . . . . 0.0 112.072 -174.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.56 8.31 25.54 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.015 176.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -63.87 154.81 32.54 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 118.265 1.032 . . . . 0.0 111.312 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 60.9 m -70.79 157.66 89.73 Favored Pre-proline 0 N--CA 1.456 -0.166 0 C-N-CA 123.172 0.589 . . . . 0.0 109.908 178.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -70.23 -16.16 35.5 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.801 2.334 . . . . 0.0 112.076 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.23 -45.01 43.01 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.234 0.47 . . . . 0.0 111.075 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -82.99 -23.61 33.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.39 -30.1 68.94 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 173.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.94 -32.6 63.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 110.329 -0.249 . . . . 0.0 110.329 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -70.28 -22.85 62.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.766 0.427 . . . . 0.0 110.611 175.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.0 tp -83.4 -7.55 59.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.415 HG13 HG22 ' A' ' 121' ' ' VAL . 23.5 pt -134.92 11.41 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.775 -0.578 . . . . 0.0 110.369 175.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 54.04 59.85 3.99 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.998 1.319 . . . . 0.0 113.364 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.415 HG22 HG13 ' A' ' 119' ' ' ILE . 33.5 m -138.0 -176.19 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 C-N-CA 124.702 1.201 . . . . 0.0 109.336 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -88.66 160.21 17.48 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 175.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.6 m -55.97 -40.83 73.84 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 122.745 0.418 . . . . 0.0 111.067 -177.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.5 m -69.81 -20.72 63.44 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.926 0.491 . . . . 0.0 111.787 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -77.48 -34.38 54.29 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.424 0.556 . . . . 0.0 110.124 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.3 t -64.98 -36.65 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.061 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.49 -38.45 87.37 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 178.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.3 m -71.44 -40.55 70.32 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-O 119.678 -0.201 . . . . 0.0 110.696 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.0 mp -64.02 -34.58 78.34 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.001 0.364 . . . . 0.0 111.82 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -81.17 -27.06 10.61 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.414 0.552 . . . . 0.0 111.032 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 61.6 m -68.95 -37.91 79.12 Favored 'General case' 0 C--N 1.339 0.118 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -77.13 -25.52 52.18 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 122.275 -0.266 . . . . 0.0 110.658 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.67 -48.4 47.81 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.399 -0.188 . . . . 0.0 110.557 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.4 -22.61 61.85 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 117.723 0.238 . . . . 0.0 111.235 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.94 71.34 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.737 0.244 . . . . 0.0 110.371 177.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -75.57 -18.95 59.6 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.875 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.9 mm -78.61 -55.18 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 176.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.08 -23.26 67.26 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.677 0.217 . . . . 0.0 111.194 -175.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.84 -24.35 62.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -158.96 -37.33 0.06 Allowed 'General case' 0 C--O 1.226 -0.139 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -171.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.7 p 45.63 -4.78 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 116.471 2.026 . . . . 0.0 116.471 -169.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.18 4.15 0.06 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 121.002 1.728 . . . . 0.0 114.088 174.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 47.81 39.23 10.13 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.978 0.911 . . . . 0.0 113.174 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -56.07 -28.17 56.5 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -176.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -153.04 172.74 16.39 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 123.324 0.65 . . . . 0.0 109.984 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 55.5 tp -153.55 151.32 29.64 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.704 0.802 . . . . 0.0 108.984 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 4.9 p -152.48 90.22 3.74 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 120.91 0.386 . . . . 0.0 109.966 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.04 -8.12 18.65 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.257 2.638 . . . . 0.0 111.757 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 -72.95 170.42 14.85 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 123.193 0.597 . . . . 0.0 110.566 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 172.61 -12.49 0.04 OUTLIER Glycine 0 CA--C 1.529 0.965 0 CA-C-O 119.37 -0.683 . . . . 0.0 112.958 178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 50.8 m -149.55 167.37 26.49 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 117.944 0.872 . . . . 0.0 110.617 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 56.5 p-80 -157.55 177.24 11.64 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.612 0.765 . . . . 0.0 110.187 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -150.44 170.21 19.62 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -151.32 28.39 0.65 Allowed 'General case' 0 CA--C 1.532 0.271 0 O-C-N 122.159 -0.338 . . . . 0.0 111.763 -174.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -137.74 18.45 2.87 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.889 -0.507 . . . . 0.0 111.914 -177.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 16.7 p-80 -139.89 8.25 2.31 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.103 -0.373 . . . . 0.0 111.747 178.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 9.0 p80 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 117.329 -1.32 . . . . 0.0 110.983 179.269 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . 0.414 ' C ' HD12 ' B' ' 2' ' ' LEU . 2.1 pp -151.96 -178.3 6.67 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.641 0.377 . . . . 0.0 110.759 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -149.54 169.1 21.71 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 123.464 0.705 . . . . 0.0 110.421 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.4 ' N ' HD23 ' B' ' 4' ' ' LEU . 2.0 pt? -154.87 154.59 29.25 Favored Pre-proline 0 N--CA 1.453 -0.304 0 C-N-CA 123.21 0.604 . . . . 0.0 110.661 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -74.01 172.58 15.64 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.419 2.746 . . . . 0.0 111.122 177.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -173.42 2.13 0.03 OUTLIER Glycine 0 CA--C 1.528 0.904 0 CA-C-O 119.711 -0.494 . . . . 0.0 112.48 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -153.72 167.29 30.11 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.868 0.834 . . . . 0.0 109.796 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -153.45 173.68 15.37 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.258 0.623 . . . . 0.0 110.319 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -152.38 172.82 15.9 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.086 0.554 . . . . 0.0 110.35 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -144.04 172.19 13.22 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.34 0.656 . . . . 0.0 110.428 -178.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -144.68 11.45 1.44 Allowed 'General case' 0 CA--C 1.527 0.073 0 C-N-CA 123.825 0.85 . . . . 0.0 111.033 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.16 174.07 13.2 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.786 0.834 . . . . 0.0 109.822 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 13.3 t -144.3 4.83 1.24 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.469 0.307 . . . . 0.0 111.767 -177.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 31.4 m 46.68 36.28 3.63 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.542 0.737 . . . . 0.0 112.37 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -140.84 170.3 16.01 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.545 0.738 . . . . 0.0 109.852 -176.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -140.3 167.62 21.71 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.522 0.729 . . . . 0.0 109.708 -176.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 58.8 m -139.37 159.68 64.98 Favored Pre-proline 0 C--O 1.232 0.15 0 C-N-CA 123.531 0.732 . . . . 0.0 110.157 -176.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -69.31 178.24 4.49 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 123.644 2.896 . . . . 0.0 111.446 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -147.28 -174.39 4.5 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.804 0.842 . . . . 0.0 110.736 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -145.05 147.77 32.95 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 173.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 2.0 t -139.65 21.94 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 122.928 0.491 . . . . 0.0 110.117 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -131.67 15.51 4.87 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.816 0.847 . . . . 0.0 110.296 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 22.2 m -138.16 20.93 2.8 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.214 1.005 . . . . 0.0 110.124 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -135.24 -19.58 1.7 Allowed 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.849 0.86 . . . . 0.0 111.287 -176.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -139.72 7.0 2.28 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.171 0.989 . . . . 0.0 109.496 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.532 ' HG2' ' H ' ' B' ' 27' ' ' ASP . 17.8 ttp180 50.39 -164.49 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.751 1.221 . . . . 0.0 112.227 -178.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . 0.532 ' H ' ' HG2' ' B' ' 26' ' ' ARG . 8.7 p-10 -65.05 -8.4 16.07 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 123.708 0.803 . . . . 0.0 112.793 -177.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -62.82 -27.78 69.55 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.805 -0.559 . . . . 0.0 111.014 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.34 -37.46 62.97 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.46 -22.11 57.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.44 -0.447 . . . . 0.0 110.85 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.48 -44.23 68.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 120.856 0.36 . . . . 0.0 110.136 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 68.5 mt -73.71 -37.39 65.16 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 122.744 0.418 . . . . 0.0 110.095 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.25 -37.76 86.27 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.502 -0.285 . . . . 0.0 110.636 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.1 t -69.49 -37.19 77.11 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 117.74 0.246 . . . . 0.0 111.381 -178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.89 -30.35 71.45 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 120.545 0.212 . . . . 0.0 111.152 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -105.59 -6.58 19.17 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -67.7 -34.43 76.88 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -57.72 -33.76 68.77 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.441 0.697 . . . . 0.0 110.345 175.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 23.4 m -67.85 -12.47 60.7 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.183 0.593 . . . . 0.0 112.065 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 44.9 mm -110.2 -12.6 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 118.298 0.499 . . . . 0.0 111.165 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -77.62 25.36 0.19 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.194 0.598 . . . . 0.0 110.991 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -141.52 176.05 9.19 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.226 0.61 . . . . 0.0 111.374 -178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -66.14 178.06 1.25 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.526 1.131 . . . . 0.0 112.326 -177.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -138.25 156.88 73.51 Favored Pre-proline 0 CA--C 1.531 0.216 0 C-N-CA 123.96 0.904 . . . . 0.0 109.923 -178.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -74.55 176.15 10.11 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 123.058 2.505 . . . . 0.0 110.449 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -147.09 -2.21 0.62 Allowed 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 179.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.16 -23.27 67.07 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.807 -0.558 . . . . 0.0 111.802 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.9 mtm -73.16 -35.27 66.42 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 110.583 -0.154 . . . . 0.0 110.583 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 49' ' ' LEU . 67.7 mt -81.55 -12.32 58.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.713 -0.617 . . . . 0.0 110.084 175.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.0 -20.66 61.68 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 171.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 62.2 mt -71.0 -16.24 62.61 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.987 -0.446 . . . . 0.0 110.417 173.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.433 ' C ' ' H ' ' B' ' 54' ' ' LYS . 29.6 mt -90.51 -17.0 27.82 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 173.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -71.47 16.12 0.11 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.014 0.37 . . . . 0.0 111.468 178.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.433 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -133.8 9.35 3.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.184 0.993 . . . . 0.0 111.171 177.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 pp -153.83 -11.68 0.14 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -141.61 5.07 1.78 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.205 0.911 . . . . 0.0 113.262 -179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 7.6 tp -150.07 21.84 0.86 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.711 0.687 . . . . 0.0 111.54 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.19 158.95 33.92 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 121.356 -0.84 . . . . 0.0 110.857 177.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 51.4 tp -158.56 155.97 29.3 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 41.9 t -144.06 136.79 13.59 Favored Pre-proline 0 CA--C 1.531 0.235 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 178.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -72.71 177.02 8.08 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 123.554 2.836 . . . . 0.0 111.167 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 . . . . . 0 CA--C 1.532 0.258 0 C-N-CA 124.441 1.097 . . . . 0.0 111.735 -179.272 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 110.611 -0.144 . . . . 0.0 110.611 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.6 p -151.0 170.81 18.44 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.092 0.557 . . . . 0.0 109.712 177.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.77 -35.43 74.61 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 122.624 0.37 . . . . 0.0 111.251 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -66.75 -27.25 73.2 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 -176.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -73.89 -1.16 18.44 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 117.413 0.606 . . . . 0.0 111.421 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -135.37 4.31 3.15 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.407 0.683 . . . . 0.0 110.797 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 tt -114.56 -41.25 3.45 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 122.975 0.51 . . . . 0.0 110.113 178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.439 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.98 -44.65 99.79 Favored Pre-proline 0 CA--C 1.533 0.291 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.5 Cg_endo -72.61 -2.49 11.91 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.092 1.861 . . . . 0.0 112.521 -178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -135.01 13.35 3.6 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.995 0.518 . . . . 0.0 110.97 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.431 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 45.9 tp -62.09 -39.57 59.35 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 76.8 Cg_endo -75.77 -11.69 20.1 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.665 1.577 . . . . 0.0 113.316 -176.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.405 ' CE1' HD11 ' B' ' 40' ' ' ILE . 47.8 m-85 -70.26 -22.8 62.84 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.66 0.663 . . . . 0.0 112.553 -173.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.0 -29.8 64.59 Favored 'General case' 0 C--O 1.227 -0.119 0 CA-C-N 118.664 0.666 . . . . 0.0 109.59 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -80.51 -28.19 37.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.995 0.518 . . . . 0.0 109.8 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -56.29 -22.53 30.92 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 124.297 1.039 . . . . 0.0 112.171 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -140.27 -8.83 1.14 Allowed 'General case' 0 N--CA 1.457 -0.106 0 CA-C-N 117.812 0.278 . . . . 0.0 111.737 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.86 -28.45 73.06 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -72.29 -4.84 32.03 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.789 0.794 . . . . 0.0 111.655 177.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.45 6.3 5.25 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.192 0.597 . . . . 0.0 111.374 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.6 tp -99.9 -1.95 36.04 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.208 0.603 . . . . 0.0 110.193 177.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 t -148.05 -0.3 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.889 0.875 . . . . 0.0 110.754 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.98 -0.62 10.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 124.395 0.998 . . . . 0.0 114.919 173.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.7 m -139.18 134.37 32.69 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 119.176 1.488 . . . . 0.0 110.086 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -72.31 -23.57 61.19 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.002 -174.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -65.19 -39.19 92.51 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 118.275 0.489 . . . . 0.0 110.501 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -83.43 -31.33 26.68 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.124 0.57 . . . . 0.0 110.127 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.2 -45.68 92.99 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.14 -1.184 . . . . 0.0 110.14 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -74.63 -26.4 59.86 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 117.388 0.594 . . . . 0.0 110.939 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.68 -46.38 72.48 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -64.76 -33.36 75.8 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 117.744 0.247 . . . . 0.0 111.117 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 32.4 t -62.77 -55.27 24.76 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 117.825 0.284 . . . . 0.0 110.656 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -74.5 -29.17 61.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.119 -176.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.81 -25.04 63.58 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 119.789 -0.148 . . . . 0.0 110.984 177.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.88 -45.67 85.03 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 117.894 0.316 . . . . 0.0 110.231 177.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.6 tt -80.55 -36.45 33.01 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 119.839 -0.744 . . . . 0.0 111.564 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -61.94 -27.03 68.54 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.341 0.518 . . . . 0.0 110.242 178.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.45 -1.19 25.86 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.244 0.618 . . . . 0.0 111.662 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.0 mt -118.98 -13.56 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.725 0.81 . . . . 0.0 110.082 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 41.2 t -58.59 -12.31 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 123.694 0.798 . . . . 0.0 111.799 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.26 3.3 9.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.321 0.649 . . . . 0.0 111.42 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.41 55.26 1.03 Allowed Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.561 0.745 . . . . 0.0 110.531 -177.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.87 -8.93 21.2 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.512 2.808 . . . . 0.0 112.759 -174.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -80.47 -8.58 59.61 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.776 0.43 . . . . 0.0 111.403 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -88.44 -17.18 30.97 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 122.294 0.237 . . . . 0.0 111.633 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.52 120.2 80.66 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -53.69 139.68 67.32 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 123.282 2.655 . . . . 0.0 112.389 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 54.3 mmm-85 -141.69 16.63 2.16 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.779 1.232 . . . . 0.0 110.084 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -128.17 20.85 6.3 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.95 0.9 . . . . 0.0 110.78 -175.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.2 m -139.37 -178.28 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 124.528 1.131 . . . . 0.0 108.999 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -53.79 146.96 24.75 Favored Pre-proline 0 CA--C 1.531 0.233 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.9 11.31 0.53 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 123.884 3.056 . . . . 0.0 111.676 -176.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -127.94 -22.21 3.54 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.631 0.773 . . . . 0.0 111.022 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.8 tp -74.42 -34.36 63.21 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.173 0.442 . . . . 0.0 110.251 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.71 -30.4 61.89 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.43 -43.58 93.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.203 0.601 . . . . 0.0 110.111 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -81.01 -29.78 35.08 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -177.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -66.24 -40.63 90.37 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-N 117.897 0.317 . . . . 0.0 111.129 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.3 mmm -74.94 -35.74 62.13 Favored 'General case' 0 N--CA 1.457 -0.118 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -66.75 -35.91 81.21 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 117.529 0.149 . . . . 0.0 110.647 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -68.71 -27.36 65.88 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 122.866 0.466 . . . . 0.0 110.017 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.58 -37.32 84.96 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.593 -0.603 . . . . 0.0 111.593 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.7 mm -72.39 -38.91 62.2 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.067 0 CA-C-N 118.014 0.907 . . . . 0.0 110.323 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -69.74 -35.5 75.03 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.23 -0.294 . . . . 0.0 110.584 -178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.31 -28.15 66.0 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 122.166 -0.333 . . . . 0.0 110.58 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.3 t -80.34 -28.06 38.18 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 122.429 0.291 . . . . 0.0 110.878 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.63 -32.26 67.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 122.227 -0.295 . . . . 0.0 111.11 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -87.01 -12.49 47.26 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 122.406 0.282 . . . . 0.0 110.876 177.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.8 5.55 43.09 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.183 0.593 . . . . 0.0 110.877 176.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -134.99 1.75 3.03 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.27 0.628 . . . . 0.0 111.027 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 69.58 25.97 74.97 Favored Glycine 0 CA--C 1.53 0.975 0 CA-C-O 119.618 -0.545 . . . . 0.0 112.572 176.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -61.58 -16.35 47.31 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.847 0.823 . . . . 0.0 111.17 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.23 164.2 39.12 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.561 0.744 . . . . 0.0 110.305 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -141.35 4.27 1.78 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.844 0.858 . . . . 0.0 110.513 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.1 t -159.27 -172.15 3.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.254 1.021 . . . . 0.0 108.921 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 87.0 p -130.61 -19.0 3.06 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.225 -0.417 . . . . 0.0 111.609 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 58.04 -19.06 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.216 1.932 . . . . 0.0 116.216 174.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 74.2 m 57.41 168.72 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.899 1.28 . . . . 0.0 113.215 -171.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -149.7 16.26 0.88 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.466 0.706 . . . . 0.0 110.936 -176.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.92 -176.39 4.97 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.925 0.49 . . . . 0.0 110.289 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -138.87 7.56 2.49 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.753 0.421 . . . . 0.0 111.857 -178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -172.51 12.42 0.04 OUTLIER Glycine 0 CA--C 1.529 0.918 0 CA-C-O 119.208 -0.774 . . . . 0.0 114.44 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.7 t -145.93 -0.63 0.8 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.845 1.322 . . . . 0.0 112.81 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -149.68 -45.92 0.13 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.08 -24.37 67.43 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.24 -28.59 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 O-C-N 122.117 -0.364 . . . . 0.0 110.545 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.63 -0.35 56.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.76 -21.09 2.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 118.168 0.44 . . . . 0.0 111.867 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -81.11 -1.94 46.35 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.071 0.548 . . . . 0.0 110.962 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.443 ' C ' HD12 ' A' ' 91' ' ' LEU . 74.5 mtp180 -129.19 -9.97 4.74 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.111 0.564 . . . . 0.0 111.734 -177.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.443 HD12 ' C ' ' A' ' 90' ' ' ARG . 10.8 mp -126.16 7.01 7.16 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.839 0.856 . . . . 0.0 111.43 -174.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.13 -9.31 1.96 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -75.21 -0.82 20.72 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.017 0.527 . . . . 0.0 111.225 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 72.0 mtm -121.13 162.48 20.0 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 122.94 0.496 . . . . 0.0 111.238 -177.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 97' ' ' LEU . 28.6 m -67.29 144.21 97.95 Favored Pre-proline 0 N--CA 1.453 -0.303 0 C-N-CA 123.749 0.819 . . . . 0.0 110.585 -179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 53.9 Cg_exo -54.59 5.26 0.04 OUTLIER 'Trans proline' 0 CA--C 1.534 0.52 0 C-N-CA 124.829 3.686 . . . . 0.0 115.344 173.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.427 ' H ' ' C ' ' A' ' 95' ' ' THR . 3.3 tm? -123.71 -37.25 2.65 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.462 0.574 . . . . 0.0 110.086 -174.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 55.1 p -67.68 -20.79 65.33 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 118.307 0.503 . . . . 0.0 110.257 175.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 33.6 mtp-105 -71.7 -23.56 61.66 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 117.656 0.207 . . . . 0.0 110.839 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -78.99 -38.07 37.69 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -66.27 -29.78 70.07 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.41 ' C ' HD13 ' A' ' 102' ' ' LEU . 3.4 tm? -62.91 -51.3 67.47 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.86 -4.92 37.84 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 71.2 mt -95.3 -7.43 38.76 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.26 0.482 . . . . 0.0 111.951 174.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 65.1 p -136.07 8.12 3.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.558 0.617 . . . . 0.0 112.488 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.09 7.66 2.68 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 122.929 0.491 . . . . 0.0 110.847 176.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.5 tpp -136.05 -15.07 1.77 Allowed 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -150.6 -21.81 0.23 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.437 0.562 . . . . 0.0 112.397 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 84.32 19.86 59.82 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 119.396 -0.669 . . . . 0.0 113.615 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -56.7 148.51 20.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.371 1.085 . . . . 0.0 110.708 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.3 m -72.68 153.41 91.49 Favored Pre-proline 0 CA--C 1.53 0.206 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -52.65 -30.11 44.34 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 123.459 2.773 . . . . 0.0 113.252 178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.03 -33.9 72.59 Favored 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.749 -0.594 . . . . 0.0 110.808 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -83.26 -36.7 24.33 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.17 -31.04 68.34 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.916 -0.129 . . . . 0.0 111.24 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.32 -36.54 61.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.879 0.309 . . . . 0.0 110.794 178.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -69.41 -23.07 63.65 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.78 0.432 . . . . 0.0 111.211 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 23.6 tp -87.7 -3.29 58.97 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.981 0.512 . . . . 0.0 111.782 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.42 HG13 HG22 ' A' ' 121' ' ' VAL . 14.0 pt -134.38 10.66 1.21 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.986 -0.446 . . . . 0.0 110.793 178.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 59.43 50.89 7.09 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.444 1.098 . . . . 0.0 113.561 173.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.42 HG22 HG13 ' A' ' 119' ' ' ILE . 28.7 m -136.03 174.66 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 C-N-CA 123.482 0.713 . . . . 0.0 110.189 175.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.17 157.38 36.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.8 m -59.46 -36.58 76.24 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 122.138 -0.351 . . . . 0.0 110.99 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.7 t -74.28 -23.81 59.16 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.004 -0.435 . . . . 0.0 111.072 -179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.35 -42.5 65.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.963 -0.461 . . . . 0.0 110.621 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.4 p -68.11 -29.68 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.454 -178.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.23 -37.94 87.28 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 176.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 88.8 m -77.11 -36.53 55.52 Favored 'General case' 0 N--CA 1.457 -0.109 0 O-C-N 122.382 -0.199 . . . . 0.0 110.488 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.14 -30.78 71.33 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 119.135 -0.459 . . . . 0.0 111.505 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.0 m -82.77 -27.69 8.31 Favored 'Isoleucine or valine' 0 C--N 1.34 0.187 0 CA-C-N 118.903 0.774 . . . . 0.0 110.805 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 84.5 m -68.1 -38.71 82.6 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -76.7 -27.02 55.33 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 122.125 -0.359 . . . . 0.0 110.615 177.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.42 -49.06 45.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.23 -22.92 63.82 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 122.152 -0.342 . . . . 0.0 111.303 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.43 -38.79 71.35 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 176.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -75.84 -18.9 59.28 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.532 -0.27 . . . . 0.0 111.105 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 16.0 mm -75.54 -55.38 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 118.402 0.546 . . . . 0.0 109.597 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -65.34 -18.42 65.3 Favored 'General case' 0 CA--C 1.527 0.083 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -75.19 -22.07 58.26 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.412 ' HG3' ' H ' ' A' ' 142' ' ' ARG . 15.9 pt20 -159.71 -37.45 0.06 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -171.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 20.0 p 43.41 24.97 0.06 Allowed 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.822 0.849 . . . . 0.0 112.517 -169.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.412 ' H ' ' HG3' ' A' ' 140' ' ' GLN . 71.7 mtt85 -144.47 -5.66 0.74 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.242 0.617 . . . . 0.0 112.475 -172.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 50.51 9.36 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 114.984 1.475 . . . . 0.0 114.984 -176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 96.4 mt -142.95 9.55 1.72 Allowed 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.969 0.804 . . . . 0.0 112.167 -174.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -71.48 -34.53 70.26 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.362 0.528 . . . . 0.0 110.91 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 10.6 mp 46.48 -165.97 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.707 1.203 . . . . 0.0 112.278 -176.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 5.1 t -140.42 53.12 3.83 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 123.671 0.788 . . . . 0.0 110.014 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.34 171.76 17.0 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.395 2.73 . . . . 0.0 111.244 -177.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 90.2 mtm-85 -144.16 162.43 36.32 Favored 'General case' 0 C--O 1.231 0.104 0 C-N-CA 124.232 1.013 . . . . 0.0 109.361 178.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 173.14 27.73 0.02 OUTLIER Glycine 0 C--N 1.338 0.642 0 CA-C-O 119.528 -0.596 . . . . 0.0 113.126 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 14.9 t -144.27 177.87 8.31 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 118.094 0.947 . . . . 0.0 110.865 -177.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 57.0 -177.08 0.06 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.963 1.305 . . . . 0.0 112.383 -175.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 53.05 24.13 3.33 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.04 0.936 . . . . 0.0 111.987 -176.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.3 7.28 1.75 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.366 0.667 . . . . 0.0 111.417 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.31 6.3 0.98 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.373 0.669 . . . . 0.0 111.472 -179.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -150.17 8.66 0.64 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.188 0.595 . . . . 0.0 110.797 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 117.742 -1.123 . . . . 0.0 111.384 -178.82 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.477 0.902 0 CA-C-O 120.208 0.051 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 96.1 mt -141.44 31.46 1.7 Allowed 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 124.797 1.239 . . . . 0.0 108.792 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -133.94 14.96 3.93 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.375 1.07 . . . . 0.0 111.822 -171.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.427 HD23 ' H ' ' B' ' 4' ' ' LEU . 1.8 pt? -147.14 163.51 27.96 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 123.092 0.557 . . . . 0.0 110.88 -179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -53.23 167.53 0.76 Allowed 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 124.508 3.472 . . . . 0.0 114.203 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -170.22 175.17 44.27 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 179.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 52.27 19.39 1.09 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.256 1.022 . . . . 0.0 112.983 -178.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -142.9 19.1 1.97 Allowed 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.57 1.148 . . . . 0.0 109.865 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -136.51 18.41 3.12 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.084 0.953 . . . . 0.0 110.977 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -138.37 20.38 2.75 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.641 0.776 . . . . 0.0 110.263 -177.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.31 -6.18 13.18 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.684 0.794 . . . . 0.0 111.833 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -151.59 165.45 34.26 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.433 0.693 . . . . 0.0 109.781 178.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 66.3 m -148.81 178.92 8.24 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.591 0.756 . . . . 0.0 110.165 -177.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 43.7 m -60.66 168.69 2.11 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 123.338 0.655 . . . . 0.0 111.755 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -64.01 -5.81 5.25 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -177.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -92.95 -0.38 57.23 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.934 0.493 . . . . 0.0 111.055 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 16.0 t -153.04 55.27 1.37 Allowed Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 123.562 0.745 . . . . 0.0 110.251 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.93 173.09 11.64 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.42 2.747 . . . . 0.0 111.301 -177.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -148.79 175.37 11.3 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.121 0.568 . . . . 0.0 110.539 -178.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -66.02 -4.83 7.92 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 17.2 m -144.86 176.99 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.339 0.109 0 C-N-CA 123.583 0.753 . . . . 0.0 110.164 178.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.9 pm0 -150.72 178.11 9.42 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.634 0.773 . . . . 0.0 110.041 -177.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -143.99 169.03 18.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 123.052 0.541 . . . . 0.0 110.16 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt 48.17 31.1 2.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.078 0.951 . . . . 0.0 112.552 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -66.73 -5.31 11.5 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.432 0.693 . . . . 0.0 112.177 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 25.0 ptt-85 -148.35 171.69 15.6 Favored 'General case' 0 C--N 1.337 0.034 0 C-N-CA 123.58 0.752 . . . . 0.0 110.065 177.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -145.82 12.07 1.27 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.126 0.57 . . . . 0.0 110.879 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -59.35 -28.06 66.5 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.275 0.63 . . . . 0.0 112.017 -177.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -69.07 -30.46 72.05 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.43 -15.73 48.54 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 117.738 0.769 . . . . 0.0 110.687 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.33 -46.31 16.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 34.2 mt -68.94 -38.7 79.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.695 177.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -67.69 -29.2 68.41 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-O 119.155 -0.45 . . . . 0.0 110.921 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.1 t -67.73 -44.45 77.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.728 0.695 . . . . 0.0 110.312 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.2 -24.41 67.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.647 -0.252 . . . . 0.0 111.248 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -107.44 -9.51 15.96 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 55.2 tp60 -70.36 -36.07 73.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 173.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -69.2 -21.23 63.97 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 122.24 -0.288 . . . . 0.0 111.143 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 58.7 m -75.79 -10.8 59.73 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.274 0.629 . . . . 0.0 111.389 177.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.405 HD11 ' CE1' ' A' ' 13' ' ' PHE . 19.1 tt -123.94 30.03 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 122.181 0.991 . . . . 0.0 110.018 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -128.41 28.91 5.39 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.43 0.692 . . . . 0.0 109.574 176.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -142.46 -176.24 4.77 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.662 0.785 . . . . 0.0 110.279 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -60.34 178.79 0.18 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.07 0.948 . . . . 0.0 112.91 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.07 155.64 74.35 Favored Pre-proline 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.238 -175.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -76.8 59.09 6.24 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 124.499 3.466 . . . . 0.0 110.533 175.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -59.85 -9.51 2.99 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.609 0.764 . . . . 0.0 111.607 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -56.62 -23.37 40.61 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.242 0.617 . . . . 0.0 111.619 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 19.3 ptp -75.92 -29.08 58.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.844 -0.535 . . . . 0.0 110.813 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 49' ' ' LEU . 64.4 mt -80.39 -11.19 59.72 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 121.615 -0.678 . . . . 0.0 109.461 174.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -72.78 -20.29 61.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 168.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 50.4 mt -78.45 -8.53 58.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.432 0.293 . . . . 0.0 110.247 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -90.42 -18.77 24.84 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 171.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -74.24 13.7 0.53 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.665 0.386 . . . . 0.0 111.251 175.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 58.8 pttt -130.97 13.3 5.24 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.119 0.968 . . . . 0.0 109.894 174.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.3 mt -137.5 -26.87 0.97 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.533 0.733 . . . . 0.0 111.394 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.94 -15.14 37.37 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 117.884 0.311 . . . . 0.0 111.581 -179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.417 ' C ' HD12 ' B' ' 57' ' ' LEU . 1.0 OUTLIER -158.23 179.04 9.53 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.346 0.658 . . . . 0.0 110.424 179.518 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -155.14 168.1 28.16 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.038 0.535 . . . . 0.0 110.61 178.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 34.0 tp -146.55 -6.97 0.52 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.535 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 47.5 t -146.19 137.35 12.75 Favored Pre-proline 0 CA--C 1.532 0.261 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.88 167.8 24.85 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 123.167 2.578 . . . . 0.0 111.243 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? . . . . . 0 C--N 1.337 0.053 0 C-N-CA 124.029 0.932 . . . . 0.0 109.621 -178.097 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 mmt . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.4 m 60.53 177.54 0.1 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 124.444 1.098 . . . . 0.0 112.851 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.9 tp 61.43 -38.9 0.12 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.476 2.31 . . . . 0.0 114.847 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.6 -24.92 64.05 Favored Glycine 0 CA--C 1.523 0.585 0 CA-C-N 119.105 0.866 . . . . 0.0 112.51 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -68.85 -2.1 8.79 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 117.597 0.698 . . . . 0.0 111.126 177.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -131.01 -21.49 2.67 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.253 0.621 . . . . 0.0 110.974 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 tp -77.91 -44.87 25.74 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 122.138 -0.351 . . . . 0.0 110.36 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.418 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.29 -46.26 99.84 Favored Pre-proline 0 CA--C 1.534 0.346 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -173.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.418 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 88.4 Cg_endo -74.69 -0.24 9.57 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.307 2.005 . . . . 0.0 112.541 -176.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -133.65 13.29 4.07 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.997 0.739 . . . . 0.0 112.997 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.411 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 42.2 mt -55.05 -43.54 99.12 Favored Pre-proline 0 CA--C 1.539 0.526 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 177.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.411 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 69.5 Cg_endo -81.12 -12.54 11.74 Favored 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 121.919 1.746 . . . . 0.0 114.016 -170.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -66.03 -23.15 66.5 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 119.123 0.874 . . . . 0.0 111.843 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.417 ' N ' HD12 ' A' ' 14' ' ' LEU . 8.0 mp -69.76 -18.85 63.52 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 118.089 0.404 . . . . 0.0 110.557 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -98.27 -20.7 17.08 Favored 'General case' 0 C--N 1.34 0.183 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -58.24 -22.26 51.57 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 123.682 0.793 . . . . 0.0 111.57 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 30.6 p90 -140.09 -24.93 0.81 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 122.247 0.219 . . . . 0.0 111.3 177.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -61.33 -29.0 70.27 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -65.47 -32.77 74.57 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 117.114 0.457 . . . . 0.0 110.635 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.47 -6.21 52.69 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.485 0.314 . . . . 0.0 111.833 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.0 mt -97.44 4.7 50.47 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -155.36 -15.8 0.11 Allowed 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -177.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.06 25.34 75.49 Favored Glycine 0 CA--C 1.527 0.812 0 O-C-N 121.577 -0.702 . . . . 0.0 112.758 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.4 t -150.67 139.95 21.29 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.188 0.994 . . . . 0.0 110.948 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -81.16 -20.2 41.79 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.425 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -71.82 -36.54 70.25 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -76.63 -32.3 57.93 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 175.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.22 -43.31 89.55 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -67.92 -31.94 72.05 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 117.071 0.435 . . . . 0.0 110.633 178.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -71.27 -42.51 68.66 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 122.379 0.272 . . . . 0.0 110.406 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -65.3 -41.41 94.13 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.576 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.0 m -68.61 -37.7 78.0 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.127 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.327 -176.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -78.8 -29.8 45.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.577 -178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.32 -26.58 62.0 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 110.302 -0.259 . . . . 0.0 110.302 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.2 m -65.59 -40.82 93.12 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -75.45 -41.78 54.89 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 110.272 -0.269 . . . . 0.0 110.272 -176.814 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.92 -24.95 68.09 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.903 -0.498 . . . . 0.0 110.649 -178.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.75 0.46 26.78 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.39 0.676 . . . . 0.0 111.594 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.1 mt -122.41 -14.85 6.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 124.112 0.965 . . . . 0.0 109.977 -176.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.8 -14.83 7.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 123.463 0.705 . . . . 0.0 111.053 175.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.69 4.41 9.51 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.413 0.685 . . . . 0.0 110.933 179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.74 53.05 0.89 Allowed Pre-proline 0 CA--C 1.532 0.261 0 C-N-CA 123.39 0.676 . . . . 0.0 111.295 -176.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -65.01 -10.72 26.62 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 123.24 2.627 . . . . 0.0 112.55 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -74.87 -13.84 60.6 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 122.53 0.332 . . . . 0.0 111.255 176.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -90.05 2.8 54.8 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.048 0.539 . . . . 0.0 111.533 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -133.77 65.08 69.84 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 122.483 0.313 . . . . 0.0 111.135 -174.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -76.39 179.95 5.89 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 124.681 3.587 . . . . 0.0 111.396 -175.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 78.7 mmt-85 -132.56 16.42 4.4 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.662 1.185 . . . . 0.0 109.823 176.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -71.86 8.89 1.04 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.185 0.994 . . . . 0.0 110.902 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.63 178.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 C-N-CA 124.974 1.309 . . . . 0.0 108.693 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -53.73 146.09 27.88 Favored Pre-proline 0 CA--C 1.529 0.166 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -70.18 10.77 0.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.979 3.119 . . . . 0.0 111.983 -175.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -132.63 -17.53 2.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.325 0.65 . . . . 0.0 111.127 179.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 54.1 tp -75.93 -36.41 59.4 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 118.374 0.534 . . . . 0.0 110.558 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.81 -32.07 54.51 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.261 -1.136 . . . . 0.0 110.261 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -58.6 -42.84 89.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.768 0.827 . . . . 0.0 109.854 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 -79.61 -28.6 40.97 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -66.94 -41.27 87.26 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 118.242 0.474 . . . . 0.0 111.257 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 93.4 mmm -75.37 -32.27 60.77 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.241 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -68.67 -35.93 77.87 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.92 -26.86 67.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.773 0.429 . . . . 0.0 110.117 177.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.84 -38.36 65.69 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.496 -0.641 . . . . 0.0 111.496 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.7 mm -74.44 -35.98 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 CA-C-N 117.886 0.843 . . . . 0.0 110.046 177.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -67.68 -32.15 72.62 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.501 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.22 -32.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.937 -0.477 . . . . 0.0 110.207 175.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.1 t -73.22 -26.37 61.11 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.74 -30.86 51.84 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 122.334 0.253 . . . . 0.0 110.454 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -76.65 -15.12 59.9 Favored 'General case' 0 CA--C 1.528 0.125 0 O-C-N 122.107 -0.371 . . . . 0.0 110.314 173.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -93.05 7.58 43.54 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.608 0.763 . . . . 0.0 110.628 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -138.31 0.54 2.11 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.287 0.635 . . . . 0.0 111.39 -179.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.92 33.2 46.76 Favored Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.641 -0.533 . . . . 0.0 112.525 175.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -123.47 10.7 9.18 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.017 0.909 . . . . 0.0 111.253 -177.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.73 24.28 1.53 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.874 0.469 . . . . 0.0 111.205 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -102.66 6.3 39.55 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.07 0.548 . . . . 0.0 110.809 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 11.8 t -155.08 174.37 15.27 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.497 0.719 . . . . 0.0 109.824 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.6 p -154.15 176.4 12.3 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.305 0.642 . . . . 0.0 110.816 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -145.94 -12.82 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.972 0.509 . . . . 0.0 112.009 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.3 m 61.5 168.16 0.1 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.663 1.185 . . . . 0.0 112.817 -173.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -144.69 14.42 1.56 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.03 0.932 . . . . 0.0 110.507 -177.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.3 -179.3 6.75 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.919 0.888 . . . . 0.0 109.578 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -136.34 11.98 3.26 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.441 0.296 . . . . 0.0 111.707 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -164.27 12.08 0.09 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 119.394 -0.67 . . . . 0.0 113.827 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -149.78 7.91 0.66 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 1.127 . . . . 0.0 111.63 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -150.3 -48.24 0.13 Allowed 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.35 -28.21 41.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 122.553 0.341 . . . . 0.0 110.819 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.8 0.76 55.35 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.096 0.558 . . . . 0.0 111.926 -178.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 19.0 tpt180 -121.48 -39.89 2.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 122.861 0.465 . . . . 0.0 110.012 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.35 -1.31 7.93 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -130.11 -2.95 4.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.221 0.608 . . . . 0.0 111.337 -178.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 61.8 mt -137.52 20.17 2.91 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.918 0.887 . . . . 0.0 111.13 -176.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.06 4.49 0.05 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -175.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -129.4 0.47 5.06 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.091 0.86 . . . . 0.0 112.085 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 54.5 ttm -71.55 149.55 45.61 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.8 m -57.43 140.11 79.92 Favored Pre-proline 0 CA--C 1.53 0.186 0 C-N-CA 123.648 0.779 . . . . 0.0 109.707 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -65.54 5.4 0.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 124.031 3.154 . . . . 0.0 113.919 -176.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.3 tp -128.97 -22.99 3.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.477 0.581 . . . . 0.0 110.682 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 71.0 m -69.32 -22.89 63.75 Favored 'General case' 0 N--CA 1.457 -0.075 0 O-C-N 121.891 -0.505 . . . . 0.0 109.922 174.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 40.4 mtp-105 -68.05 -32.54 72.96 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 175.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -76.39 -39.0 54.88 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.07 -30.45 71.52 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.1 tp -66.84 -46.59 74.6 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.402 0.281 . . . . 0.0 110.283 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 25.0 mt -74.89 -8.94 57.97 Favored 'General case' 0 N--CA 1.46 0.04 0 O-C-N 122.13 -0.356 . . . . 0.0 110.73 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -95.67 -8.4 34.83 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -140.65 -20.34 0.83 Allowed 'General case' 0 C--N 1.339 0.121 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.53 -10.85 58.04 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 119.121 0.873 . . . . 0.0 111.591 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 16.1 ptp -149.83 11.3 0.74 Allowed 'General case' 0 N--CA 1.457 -0.091 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -174.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -138.08 -13.13 1.42 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.856 0.753 . . . . 0.0 112.15 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.84 10.04 36.59 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 119.009 -0.884 . . . . 0.0 114.493 173.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -59.2 150.44 25.53 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-N 118.808 1.304 . . . . 0.0 110.132 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 94.4 p -67.87 157.19 87.44 Favored Pre-proline 0 N--CA 1.454 -0.235 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.246 179.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -69.45 -16.17 38.7 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 122.775 2.317 . . . . 0.0 110.866 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -79.16 -44.73 21.37 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.63 0.372 . . . . 0.0 110.733 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -78.67 -27.52 45.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 121.959 -0.463 . . . . 0.0 109.865 177.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.96 -27.64 64.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.905 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -75.64 -32.55 60.26 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 110.423 -0.214 . . . . 0.0 110.423 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -70.02 -28.95 65.91 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.635 0.374 . . . . 0.0 110.349 176.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 17.3 tp -76.87 -9.04 58.41 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 21.1 pt -134.98 12.29 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 117.931 0.332 . . . . 0.0 110.812 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 52.34 60.8 3.56 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.904 1.281 . . . . 0.0 113.7 176.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.36 -175.28 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.43 1.092 . . . . 0.0 109.492 175.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -88.4 160.64 17.48 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 26.8 m -56.32 -40.49 74.48 Favored 'General case' 0 N--CA 1.458 -0.065 0 O-C-N 122.115 -0.365 . . . . 0.0 111.341 -178.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 51.9 m -70.54 -20.54 62.8 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.688 0.395 . . . . 0.0 111.907 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -74.91 -37.7 62.01 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 121.954 -0.466 . . . . 0.0 109.834 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.63 -38.68 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.01 -33.02 74.54 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.79 -0.078 . . . . 0.0 110.79 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 91.4 m -78.12 -39.66 40.6 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -64.84 -34.03 77.42 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 119.331 -0.366 . . . . 0.0 111.184 -179.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.5 m -80.49 -27.54 11.6 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 CA-C-N 118.515 0.598 . . . . 0.0 110.993 178.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.9 m -69.23 -38.78 78.7 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 178.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -76.04 -25.65 55.84 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.28 -47.85 46.92 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 117.674 0.216 . . . . 0.0 110.432 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.7 -22.77 65.25 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.337 0.517 . . . . 0.0 111.264 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -77.41 -34.38 54.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.91 0.386 . . . . 0.0 110.587 174.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 49.3 tp10 -77.39 -27.46 52.49 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 123.366 0.666 . . . . 0.0 110.094 179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.9 mm -66.66 -60.07 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.19 -23.69 67.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 -171.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 4.3 ptpp? -71.9 -10.2 59.44 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -151.53 -50.07 0.12 Allowed 'General case' 0 C--N 1.34 0.19 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -177.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 42.9 p 43.57 -10.45 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 127.698 2.399 . . . . 0.0 117.371 -171.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.25 12.02 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 120.803 1.638 . . . . 0.0 113.788 -174.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -144.92 169.18 18.56 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 118.645 0.657 . . . . 0.0 112.02 -176.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -126.5 6.42 6.91 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.248 1.019 . . . . 0.0 109.641 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -79.94 21.17 0.57 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.324 1.049 . . . . 0.0 112.258 -174.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.463 HD23 ' H ' ' A' ' 147' ' ' VAL . 0.7 OUTLIER -137.9 165.17 27.17 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.109 -0.369 . . . . 0.0 110.694 -178.561 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.463 ' H ' HD23 ' A' ' 146' ' ' LEU . 29.0 m 39.26 48.7 1.97 Allowed Pre-proline 0 CA--C 1.537 0.453 0 C-N-CA 125.017 1.327 . . . . 0.0 113.585 -176.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -75.4 -7.25 18.64 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 C-N-CA 123.192 2.595 . . . . 0.0 111.658 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.556 ' HG2' ' H ' ' A' ' 150' ' ' GLY . 36.8 ttt-85 -155.0 -170.98 3.67 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.271 0.628 . . . . 0.0 109.655 -178.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.556 ' H ' ' HG2' ' A' ' 149' ' ' ARG . . . -146.07 -172.99 16.91 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -177.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 80.9 p -139.51 16.23 2.55 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.862 0.465 . . . . 0.0 112.172 -175.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -71.77 4.48 3.22 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.014 0.526 . . . . 0.0 111.817 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 55.75 12.94 0.93 Allowed 'General case' 0 C--N 1.34 0.161 0 C-N-CA 125.521 1.528 . . . . 0.0 114.329 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 33.3 p-80 -74.96 0.33 16.16 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.652 -0.655 . . . . 0.0 111.039 175.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -149.34 24.04 0.91 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.499 1.12 . . . . 0.0 110.765 -176.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -146.84 170.97 15.93 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.025 0.53 . . . . 0.0 110.141 -179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 64.9 m80 . . . . . 0 C--O 1.253 1.239 0 CA-C-O 117.461 -1.257 . . . . 0.0 110.155 -176.935 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.61 164.92 15.75 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.087 0.47 . . . . 0.0 109.754 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -147.18 1.59 0.74 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.509 0.724 . . . . 0.0 110.917 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.04 163.32 51.97 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 123.224 0.61 . . . . 0.0 110.383 178.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_exo -53.41 -16.79 7.94 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.87 3.047 . . . . 0.0 113.537 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 176.93 170.97 40.05 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -158.07 175.05 14.3 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.277 0.631 . . . . 0.0 109.979 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -143.66 156.83 44.68 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 122.908 0.483 . . . . 0.0 110.154 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -157.11 8.71 0.18 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.227 0.611 . . . . 0.0 110.939 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . 0.461 ' HG3' ' H ' ' B' ' 11' ' ' LYS . 47.2 tptt -150.68 178.28 9.25 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.544 0.738 . . . . 0.0 109.483 -175.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.461 ' H ' ' HG3' ' B' ' 10' ' ' LYS . 21.4 tptm -129.31 16.3 6.07 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.736 0.815 . . . . 0.0 110.438 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.18 175.49 11.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.87 0.868 . . . . 0.0 109.605 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 93.2 p -148.88 -179.81 7.28 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 122.689 0.396 . . . . 0.0 110.892 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 48.1 m -140.19 27.47 2.14 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.462 0.705 . . . . 0.0 111.18 -175.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -129.41 7.0 5.31 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -71.03 -175.18 1.09 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.267 0.627 . . . . 0.0 110.185 174.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 56.4 m -134.52 156.35 78.87 Favored Pre-proline 0 CA--C 1.528 0.129 0 C-N-CA 122.943 0.497 . . . . 0.0 110.591 -176.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -73.12 178.65 6.27 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.971 3.114 . . . . 0.0 111.918 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -147.91 176.31 10.26 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.878 0.871 . . . . 0.0 110.278 -179.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -150.96 150.11 30.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 178.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 30.4 m -145.52 -176.36 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 C-N-CA 124.035 0.934 . . . . 0.0 110.15 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -142.81 11.26 1.82 Allowed 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.969 0.508 . . . . 0.0 111.453 -176.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 16.1 m -143.64 -172.73 3.79 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.423 0.689 . . . . 0.0 109.884 -176.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -131.28 162.46 29.97 Favored 'General case' 0 C--N 1.339 0.109 0 CA-C-O 121.056 0.455 . . . . 0.0 111.681 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -155.26 13.49 0.37 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.139 0.976 . . . . 0.0 110.228 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -59.58 -17.17 30.68 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.952 1.093 . . . . 0.0 113.952 -171.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -144.66 -8.58 0.64 Allowed 'General case' 0 CA--C 1.527 0.061 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.7 tpt -67.02 -25.23 66.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.708 0.686 . . . . 0.0 110.707 178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.6 -29.55 65.52 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.14 -27.08 59.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 117.234 0.517 . . . . 0.0 110.549 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.67 -41.52 71.96 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.38 -43.01 70.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.013 0.525 . . . . 0.0 110.341 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -69.43 -29.79 67.59 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 119.041 -0.505 . . . . 0.0 111.246 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.2 t -65.9 -43.59 87.76 Favored 'General case' 0 N--CA 1.457 -0.11 0 CA-C-N 118.863 0.756 . . . . 0.0 110.191 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.11 -30.56 71.1 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.595 0.236 . . . . 0.0 110.666 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -100.49 -3.13 31.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.183 -0.323 . . . . 0.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -70.42 -31.95 69.36 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 173.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -62.86 -33.0 74.35 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 172.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 20.6 m -81.22 -4.06 54.3 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.756 0.823 . . . . 0.0 113.101 -177.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 10.4 tp -119.54 -12.02 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 119.166 0.893 . . . . 0.0 112.262 -177.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -83.18 -3.68 57.62 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.897 -0.502 . . . . 0.0 111.172 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.78 170.58 15.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.612 0.72 . . . . 0.0 111.799 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -71.89 -173.76 1.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.068 0.947 . . . . 0.0 110.284 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.9 m -131.58 149.46 73.56 Favored Pre-proline 0 C--O 1.232 0.161 0 C-N-CA 122.608 0.363 . . . . 0.0 110.114 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -76.5 -27.86 7.3 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.291 2.661 . . . . 0.0 113.437 -175.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.5 t70 52.53 -2.67 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.038 1.735 . . . . 0.0 115.138 -178.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -67.54 -17.04 64.5 Favored 'General case' 0 N--CA 1.457 -0.111 0 O-C-N 121.112 -0.992 . . . . 0.0 111.399 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 28.1 mtm -71.05 -31.25 67.64 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.324 -0.235 . . . . 0.0 110.401 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 82.4 mt -85.87 -9.72 56.51 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 121.977 -0.452 . . . . 0.0 109.959 173.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -73.13 -20.21 60.97 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.708 -0.62 . . . . 0.0 109.552 169.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 80.9 mt -77.22 -12.38 59.94 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 122.566 0.346 . . . . 0.0 110.245 173.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -88.51 -18.59 27.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.764 0.425 . . . . 0.0 109.957 171.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -77.89 18.07 0.52 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.196 0.598 . . . . 0.0 111.867 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -133.5 1.35 3.41 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.769 0.428 . . . . 0.0 111.919 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 pp -154.16 2.59 0.24 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.47 -0.11 0.57 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.605 0.639 . . . . 0.0 112.201 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 2.3 mt -156.51 159.08 38.26 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.064 0.546 . . . . 0.0 110.04 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -146.52 12.31 1.16 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.64 0.776 . . . . 0.0 110.634 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.1 tp -67.96 -10.61 54.83 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.278 0.631 . . . . 0.0 112.376 -176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 30.8 m -60.95 154.32 60.61 Favored Pre-proline 0 CA--C 1.531 0.242 0 C-N-CA 123.055 0.542 . . . . 0.0 111.36 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.41 171.07 18.45 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.388 2.726 . . . . 0.0 110.755 177.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 . . . . . 0 CA--C 1.528 0.097 0 C-N-CA 123.656 0.782 . . . . 0.0 110.084 179.112 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.8 ttp . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.4 p -142.51 25.08 1.87 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 123.132 0.573 . . . . 0.0 111.701 -177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 65.3 tp -55.94 -35.63 66.86 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 122.79 0.436 . . . . 0.0 111.527 -178.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.53 -36.02 92.81 Favored Glycine 0 C--N 1.341 0.814 0 O-C-N 121.692 -0.63 . . . . 0.0 111.69 -177.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -73.77 1.87 9.54 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.612 0.765 . . . . 0.0 111.309 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -130.84 1.92 4.38 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.674 0.79 . . . . 0.0 110.955 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -114.34 -38.15 4.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.293 0.637 . . . . 0.0 109.865 177.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.446 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.29 -43.42 96.62 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 71.7 Cg_endo -73.34 -1.17 10.23 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.357 2.038 . . . . 0.0 112.867 -176.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -134.14 8.74 3.76 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.248 0.619 . . . . 0.0 110.409 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.7 tp -59.75 -41.87 88.17 Favored Pre-proline 0 N--CA 1.452 -0.362 0 C-N-CA 125.362 1.465 . . . . 0.0 114.141 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.28 -10.76 14.84 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.818 1.679 . . . . 0.0 112.48 -175.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -66.94 -20.45 65.9 Favored 'General case' 0 CA--C 1.529 0.169 0 O-C-N 121.753 -0.592 . . . . 0.0 111.059 -177.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.0 mt -71.8 -21.63 61.68 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.095 0.407 . . . . 0.0 110.71 178.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 59.4 ttp180 -94.57 -22.19 18.36 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -55.8 -27.52 51.55 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 124.579 1.152 . . . . 0.0 111.674 -178.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.9 p90 -140.09 -18.89 0.9 Allowed 'General case' 0 N--CA 1.458 -0.074 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.51 -25.74 74.63 Favored Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.269 -0.733 . . . . 0.0 111.269 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -81.8 -9.52 59.59 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-N 117.377 0.588 . . . . 0.0 110.978 178.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -109.4 -1.32 18.5 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.616 0.767 . . . . 0.0 110.497 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.5 tp -89.83 5.96 43.88 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.091 0.956 . . . . 0.0 109.444 175.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 37.2 p -142.28 -14.26 0.79 Allowed 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.696 0.799 . . . . 0.0 111.902 -175.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.482 ' HA3' ' H ' ' A' ' 77' ' ' GLN . . . 64.04 13.86 54.27 Favored Glycine 0 CA--C 1.53 1.031 0 CA-C-O 119.619 -0.545 . . . . 0.0 112.965 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.5 t -142.06 133.25 26.24 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 117.887 0.843 . . . . 0.0 110.332 -178.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -70.54 -27.16 63.95 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.168 -177.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -75.03 -35.88 61.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.52 -0.112 . . . . 0.0 110.798 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -75.92 -32.4 59.58 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.504 -0.122 . . . . 0.0 110.894 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -73.3 -42.45 42.28 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -71.91 -27.89 63.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 117.591 0.696 . . . . 0.0 111.375 -177.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.71 -26.28 34.76 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.782 0.719 . . . . 0.0 111.747 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -73.8 -31.21 63.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 118.812 0.733 . . . . 0.0 109.897 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.411 HG12 ' SD ' ' B' ' 48' ' ' MET . 26.6 t -63.92 -51.88 63.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.208 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 177.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 49.9 ttp180 -73.99 -27.78 61.14 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 120.786 -0.366 . . . . 0.0 111.409 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.98 -25.09 61.71 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 117.461 0.118 . . . . 0.0 110.734 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 69.3 m -65.02 -45.37 85.81 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 119.093 -0.479 . . . . 0.0 110.327 178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.438 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -72.88 -35.18 67.1 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.605 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -62.91 -23.95 67.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.532 -0.73 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.8 -0.1 33.11 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.82 0.448 . . . . 0.0 111.687 176.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 19.5 mm -110.87 -19.55 6.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 123.373 0.669 . . . . 0.0 109.494 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.3 t -59.68 -13.76 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 124.137 0.975 . . . . 0.0 113.076 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 2.24 9.63 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.859 -0.526 . . . . 0.0 111.181 -178.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -160.55 59.17 1.15 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 C-N-CA 123.136 0.574 . . . . 0.0 110.419 -177.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -65.28 -10.72 27.02 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.441 2.761 . . . . 0.0 112.679 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -76.35 -13.12 60.15 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 122.963 0.505 . . . . 0.0 111.446 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -80.11 -22.62 41.94 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-N 118.044 0.383 . . . . 0.0 111.463 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -78.36 121.59 83.99 Favored Pre-proline 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -50.44 142.55 29.87 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.558 2.839 . . . . 0.0 112.998 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.0 mmt85 -134.98 8.94 3.52 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.934 0.894 . . . . 0.0 109.433 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -139.69 20.82 2.52 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.506 1.122 . . . . 0.0 110.819 -173.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 51' ' ' ASP . 4.5 t -133.4 170.57 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 -179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.418 ' H ' HG12 ' A' ' 50' ' ' VAL . 9.5 m-20 -53.26 144.54 29.53 Favored Pre-proline 0 N--CA 1.455 -0.209 0 O-C-N 122.127 -0.358 . . . . 0.0 110.604 -179.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -72.9 11.87 0.81 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 124.176 3.251 . . . . 0.0 112.008 -175.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 -131.14 -27.08 2.06 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.378 0.671 . . . . 0.0 110.512 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 57.2 tp -74.54 -36.86 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.05 -0.406 . . . . 0.0 110.261 177.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.13 -32.95 65.3 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 110.847 -0.901 . . . . 0.0 110.847 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -58.91 -45.25 90.76 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.283 0.633 . . . . 0.0 109.718 175.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -76.07 -25.92 55.99 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.895 -176.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -68.67 -42.54 77.74 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.534 0.607 . . . . 0.0 111.624 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 81.3 mmm -73.21 -33.52 65.42 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.488 0.585 . . . . 0.0 110.948 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -67.78 -38.92 84.01 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.495 177.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -66.86 -25.3 66.34 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.21 -36.92 71.57 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.3 mm -70.38 -41.02 78.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.148 0 CA-C-N 117.794 0.797 . . . . 0.0 110.011 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -70.21 -34.03 72.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.643 -0.132 . . . . 0.0 110.643 -178.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.35 -33.46 74.32 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 122.053 -0.404 . . . . 0.0 110.437 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.2 t -73.36 -30.63 63.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.14 -28.02 65.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.317 0.247 . . . . 0.0 111.024 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -89.43 -13.2 38.18 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.424 0.289 . . . . 0.0 110.934 177.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.84 2.03 47.44 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.011 0.525 . . . . 0.0 111.751 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -140.09 2.35 1.91 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.635 0.374 . . . . 0.0 111.275 179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.61 10.05 85.68 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.944 -0.473 . . . . 0.0 113.228 176.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.16 -11.76 51.42 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 117.835 0.817 . . . . 0.0 111.668 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.09 135.7 12.48 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.416 0.686 . . . . 0.0 109.333 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -148.99 4.04 0.62 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.359 0.664 . . . . 0.0 111.368 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -158.43 -172.77 3.99 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 122.939 0.496 . . . . 0.0 110.159 -175.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.0 p -138.44 -177.27 4.78 Favored 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 123.536 0.734 . . . . 0.0 110.222 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.63 ' HG2' ' H ' ' A' ' 78' ' ' SER . 33.7 tt0 -139.44 -170.03 2.81 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 122.862 0.465 . . . . 0.0 110.286 -174.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.63 ' H ' ' HG2' ' A' ' 77' ' ' GLN . 66.1 m -130.97 50.98 2.18 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.798 0.839 . . . . 0.0 110.311 -176.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -70.57 25.87 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.341 1.056 . . . . 0.0 112.225 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.452 ' H ' ' C ' ' A' ' 78' ' ' SER . . . -147.46 -178.78 6.43 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.944 1.298 . . . . 0.0 108.993 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.72 4.87 2.37 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -176.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 173.61 22.45 0.02 OUTLIER Glycine 0 CA--C 1.527 0.792 0 C-N-CA 120.27 -0.967 . . . . 0.0 114.279 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.4 t -146.93 -15.62 0.41 Allowed 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.668 1.234 . . . . 0.0 113.222 -177.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -141.22 -39.6 0.4 Allowed 'General case' 0 N--CA 1.461 0.104 0 O-C-N 121.694 -0.629 . . . . 0.0 109.729 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.11 -27.18 67.86 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 173.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.73 -24.71 36.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 122.815 0.446 . . . . 0.0 110.668 177.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.88 -0.74 57.37 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -177.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.62 -23.78 2.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.475 0.579 . . . . 0.0 111.757 174.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.31 -1.62 24.51 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.011 0.524 . . . . 0.0 111.298 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.432 ' C ' HD22 ' A' ' 91' ' ' LEU . 69.8 mtp180 -122.95 -11.59 8.09 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 122.972 0.509 . . . . 0.0 111.034 179.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.492 HD11 HD13 ' A' ' 137' ' ' ILE . 3.0 mm? -130.08 29.56 4.91 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.198 0.999 . . . . 0.0 110.325 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.97 10.39 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.655 1.182 . . . . 0.0 113.726 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.428 ' H ' ' C ' ' A' ' 91' ' ' LEU . 87.9 mmt-85 -130.08 0.18 4.69 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.413 0.685 . . . . 0.0 111.513 -178.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.1 ttm -83.56 149.79 26.36 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 122.721 0.408 . . . . 0.0 110.432 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.1 m -63.52 138.97 97.51 Favored Pre-proline 0 CA--C 1.531 0.241 0 C-N-CA 123.722 0.809 . . . . 0.0 109.878 178.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.85 5.79 1.24 Allowed 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 124.058 3.172 . . . . 0.0 113.364 -178.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -121.3 -38.13 2.84 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 26.4 m -69.28 -24.23 63.93 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.835 -0.54 . . . . 0.0 109.955 172.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -70.73 -36.17 73.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.175 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -80.74 -24.1 38.96 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 118.613 0.642 . . . . 0.0 110.233 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.14 -33.91 76.47 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 173.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.5 tp -66.95 -41.17 87.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 69.6 mt -71.49 -5.09 30.5 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.527 0.331 . . . . 0.0 111.207 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 21.2 tp -111.81 -4.76 14.53 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.225 0.61 . . . . 0.0 112.216 -175.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.0 p -138.64 5.03 2.4 Favored 'General case' 0 C--N 1.338 0.092 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -134.38 5.65 3.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 117.859 0.299 . . . . 0.0 111.518 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.3 mtm -136.91 2.43 2.6 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.637 0.775 . . . . 0.0 111.887 176.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -148.37 -19.64 0.33 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.566 0.621 . . . . 0.0 112.404 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 66.96 15.88 65.54 Favored Glycine 0 CA--C 1.529 0.969 0 CA-C-O 119.253 -0.749 . . . . 0.0 113.614 175.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.3 m-30 -57.69 154.24 12.01 Favored 'General case' 0 C--N 1.339 0.125 0 CA-C-N 118.524 1.162 . . . . 0.0 111.453 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.1 t -63.31 146.35 96.27 Favored Pre-proline 0 N--CA 1.45 -0.448 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.554 175.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.37 -16.35 51.09 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 122.566 2.177 . . . . 0.0 111.364 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -73.99 -43.52 57.78 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.969 0.35 . . . . 0.0 110.268 178.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -78.09 -29.63 49.16 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.51 -28.82 67.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.913 -0.13 . . . . 0.0 110.812 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -74.32 -35.24 63.64 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.258 -0.275 . . . . 0.0 110.258 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -68.93 -26.26 64.99 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.659 0.384 . . . . 0.0 111.156 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -80.06 -9.07 59.67 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 18.4 pt -134.79 13.89 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 118.602 0.637 . . . . 0.0 111.371 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 58.97 53.07 5.84 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.683 1.193 . . . . 0.0 114.02 175.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.1 m -137.77 -175.69 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 C-N-CA 123.477 0.711 . . . . 0.0 110.057 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -91.88 162.31 14.48 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 175.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.1 m -58.62 -39.07 79.44 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 122.029 -0.419 . . . . 0.0 111.655 -177.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.8 p -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 111.603 0.223 . . . . 0.0 111.603 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -74.58 -36.68 63.04 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 177.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.33 -38.05 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -61.79 -37.85 85.88 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.459 0.118 . . . . 0.0 111.001 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.5 m -75.45 -38.41 59.69 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 122.123 -0.36 . . . . 0.0 110.76 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -66.53 -31.97 73.03 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.389 -0.339 . . . . 0.0 111.727 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.6 m -82.19 -26.87 9.12 Favored 'Isoleucine or valine' 0 C--N 1.339 0.135 0 CA-C-N 118.689 0.677 . . . . 0.0 110.732 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 67.0 m -68.37 -35.85 78.33 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -78.22 -27.49 47.76 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.212 -0.305 . . . . 0.0 110.537 177.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.84 -42.52 70.05 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.278 -0.264 . . . . 0.0 110.666 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -75.58 -22.24 57.13 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.11 -0.369 . . . . 0.0 111.081 177.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.27 -36.64 69.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -73.72 -21.32 60.26 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 119.448 -0.311 . . . . 0.0 110.66 176.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.492 HD13 HD11 ' A' ' 91' ' ' LEU . 11.5 mm -74.14 -53.56 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 118.335 0.516 . . . . 0.0 109.665 174.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -63.95 -22.06 66.76 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.392 0.277 . . . . 0.0 111.634 -176.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -73.68 -24.89 60.02 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -157.64 -36.38 0.07 Allowed 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -168.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 27.7 p 44.12 19.61 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.798 1.239 . . . . 0.0 114.236 -171.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.436 ' HG3' ' H ' ' A' ' 144' ' ' LEU . 20.6 ptt-85 -154.95 -13.85 0.12 Allowed 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -173.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 54.15 20.03 2.38 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 115.427 1.639 . . . . 0.0 115.427 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.436 ' H ' ' HG3' ' A' ' 142' ' ' ARG . 4.5 mm? -78.36 12.13 2.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 119.065 0.848 . . . . 0.0 110.816 173.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -140.27 169.16 18.2 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.993 0.517 . . . . 0.0 110.813 -177.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -156.1 177.74 11.08 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.691 0.797 . . . . 0.0 110.18 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.427 HG12 ' H ' ' A' ' 149' ' ' ARG . 40.4 t -142.04 132.54 12.78 Favored Pre-proline 0 N--CA 1.455 -0.198 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.05 -16.01 1.55 Allowed 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 125.108 3.872 . . . . 0.0 115.102 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.563 ' HG2' ' H ' ' A' ' 150' ' ' GLY . 28.0 ttp180 51.19 -162.46 0.07 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.945 0.898 . . . . 0.0 111.158 -176.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . 0.563 ' H ' ' HG2' ' A' ' 149' ' ' ARG . . . -171.2 -179.34 42.27 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.344 -0.702 . . . . 0.0 111.344 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 78.5 p -147.05 9.49 0.98 Allowed 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.294 0.638 . . . . 0.0 111.395 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 58.22 13.22 2.23 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.738 1.215 . . . . 0.0 114.062 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -151.2 162.24 41.25 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 118.382 0.537 . . . . 0.0 110.811 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 52.5 p-80 -167.29 169.85 12.11 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.144 0.577 . . . . 0.0 110.67 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 51.5 t60 48.21 22.49 0.44 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.121 1.368 . . . . 0.0 114.24 177.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -151.54 163.9 38.02 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.726 -0.609 . . . . 0.0 110.541 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 19.5 p-80 . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.116 1.366 . . . . 0.0 112.329 -177.82 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.5 mmt . . . . . 0 N--CA 1.476 0.862 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . 0.429 HD22 ' N ' ' B' ' 2' ' ' LEU . 3.1 mm? 51.33 27.0 3.34 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.362 1.065 . . . . 0.0 112.014 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -142.01 -0.81 1.28 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.818 0.447 . . . . 0.0 112.162 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -157.63 108.6 1.81 Allowed Pre-proline 0 N--CA 1.453 -0.313 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -49.76 141.27 28.25 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 124.526 3.484 . . . . 0.0 112.822 -179.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 167.62 -178.4 41.58 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 111.691 -0.564 . . . . 0.0 111.691 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -153.5 159.16 42.19 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.664 0.786 . . . . 0.0 109.506 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -144.9 4.08 1.1 Allowed 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.152 0.581 . . . . 0.0 112.445 -176.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -152.47 167.9 27.28 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.418 0.554 . . . . 0.0 111.234 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -156.28 163.53 39.42 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt 48.03 26.27 0.96 Allowed 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.366 1.066 . . . . 0.0 112.397 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.77 10.14 0.42 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.654 0.781 . . . . 0.0 112.627 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 68.7 m -144.23 15.28 1.67 Allowed 'General case' 0 C--O 1.232 0.139 0 C-N-CA 123.526 0.73 . . . . 0.0 110.708 -176.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 41.2 m -145.76 167.45 23.15 Favored 'General case' 0 C--N 1.338 0.105 0 C-N-CA 122.937 0.495 . . . . 0.0 110.224 -177.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -64.31 137.8 58.1 Favored 'General case' 0 C--N 1.339 0.124 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -157.63 -172.11 3.83 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 124.16 0.984 . . . . 0.0 109.218 176.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 66.3 m -137.39 155.41 75.6 Favored Pre-proline 0 N--CA 1.456 -0.145 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -69.85 149.26 66.09 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.375 2.716 . . . . 0.0 111.177 -177.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.43 172.6 15.3 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.045 0.938 . . . . 0.0 109.426 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -64.94 2.52 0.71 Allowed 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 178.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 18.6 m -138.72 12.96 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 124.085 0.954 . . . . 0.0 111.062 178.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 74.7 mm-40 -141.26 5.71 1.89 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.615 0.766 . . . . 0.0 110.913 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 20.6 t -154.58 -179.93 8.45 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 122.809 0.443 . . . . 0.0 110.102 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -63.13 177.22 0.63 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.724 0.81 . . . . 0.0 111.235 178.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -131.25 0.87 4.15 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.055 0.542 . . . . 0.0 111.759 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 20.6 ptp180 -158.95 160.94 36.6 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 122.95 0.5 . . . . 0.0 110.738 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -154.39 -6.67 0.15 Allowed 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 123.392 0.677 . . . . 0.0 110.65 176.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -63.88 -24.2 67.65 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.116 -0.365 . . . . 0.0 110.776 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -73.86 -34.06 56.68 Favored Glycine 0 C--N 1.337 0.612 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.03 -21.55 63.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.265 0.533 . . . . 0.0 110.743 178.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.45 -41.16 20.17 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.77 -42.11 58.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.448 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -66.28 -33.34 75.52 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.841 -178.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.0 t -66.02 -42.66 89.34 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.475 0.58 . . . . 0.0 109.832 178.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.37 -18.77 65.27 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -107.87 -12.47 15.18 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 122.082 -0.386 . . . . 0.0 111.571 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -69.18 -35.87 76.74 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -70.59 -23.13 62.52 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 57.9 m -70.92 -12.22 61.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.959 0.504 . . . . 0.0 111.435 175.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 38.5 pt -131.54 11.64 1.81 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 122.804 0.442 . . . . 0.0 111.641 -177.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -80.13 21.98 0.55 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.236 0.614 . . . . 0.0 110.553 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -137.7 -179.04 5.51 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.163 0.585 . . . . 0.0 111.107 -174.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -61.63 -179.9 0.21 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.066 0.946 . . . . 0.0 112.094 178.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 32.6 m -131.77 155.03 81.92 Favored Pre-proline 0 CA--C 1.528 0.113 0 C-N-CA 122.887 0.475 . . . . 0.0 110.016 -177.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -74.73 176.3 9.99 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 123.102 2.535 . . . . 0.0 110.78 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -146.46 -0.78 0.74 Allowed 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.466 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -62.38 -24.38 67.34 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.004 0.521 . . . . 0.0 111.569 -179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . 0.411 ' SD ' HG12 ' A' ' 32' ' ' VAL . 56.7 mtm -78.98 -37.11 40.2 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.577 0.351 . . . . 0.0 110.752 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -80.39 -17.02 53.09 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -69.02 -21.09 64.14 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 122.225 -0.297 . . . . 0.0 110.221 171.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.6 mt -68.53 -20.56 64.57 Favored 'General case' 0 C--O 1.228 -0.052 0 O-C-N 122.024 -0.422 . . . . 0.0 110.03 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.432 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.6 mt -80.46 -21.38 42.13 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.214 173.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -75.18 10.92 1.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 172.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.432 ' H ' ' C ' ' B' ' 52' ' ' LEU . 37.6 ttpt -120.08 -1.27 10.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.822 1.249 . . . . 0.0 110.112 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -149.43 -13.91 0.29 Allowed 'General case' 0 C--N 1.34 0.184 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -126.64 20.1 7.24 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.293 0.637 . . . . 0.0 111.908 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 tt -144.37 139.76 28.65 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -156.73 172.62 18.29 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.654 0.782 . . . . 0.0 110.256 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -151.45 170.69 18.99 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.081 0.552 . . . . 0.0 110.907 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.3 p -153.02 139.35 12.33 Favored Pre-proline 0 CA--C 1.534 0.349 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.76 170.09 20.42 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.12 2.547 . . . . 0.0 111.059 177.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 57.1 mmm-85 . . . . . 0 CA--C 1.528 0.128 0 C-N-CA 124.34 1.056 . . . . 0.0 109.941 -179.414 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 110.41 -0.218 . . . . 0.0 110.41 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.7 p -152.98 3.62 0.32 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -63.64 -12.43 33.68 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -177.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.57 -27.97 61.88 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -75.3 1.0 14.77 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.699 0.8 . . . . 0.0 111.193 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -132.27 -1.85 3.57 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.591 0.756 . . . . 0.0 111.262 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.482 HD21 ' CZ ' ' A' ' 46' ' ' PHE . 44.7 mt -111.81 -31.53 6.92 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.585 0.354 . . . . 0.0 111.052 176.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.412 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -71.39 -44.41 13.07 Favored Pre-proline 0 CA--C 1.536 0.407 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 -178.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 83.6 Cg_endo -76.73 -3.86 14.28 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.253 1.969 . . . . 0.0 112.834 -175.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.2 m-70 -135.47 14.58 3.45 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 122.949 0.5 . . . . 0.0 110.643 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 16.4 tp -56.0 -39.74 79.66 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 114.497 1.295 . . . . 0.0 114.497 -174.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.39 -4.47 13.7 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 122.083 1.855 . . . . 0.0 112.667 -178.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -65.51 -23.29 66.85 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 118.665 0.666 . . . . 0.0 111.733 -176.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mp -74.49 -18.8 60.57 Favored 'General case' 0 N--CA 1.454 -0.241 0 O-C-N 121.561 -0.712 . . . . 0.0 110.309 176.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -99.58 -27.92 13.46 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.589 0.356 . . . . 0.0 111.168 -178.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -61.39 -15.67 38.87 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -140.41 -16.8 0.92 Allowed 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 174.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.46 -26.34 74.3 Favored Glycine 0 C--N 1.338 0.661 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -66.45 -37.63 85.58 Favored 'General case' 0 C--N 1.341 0.199 0 CA-C-N 118.014 0.907 . . . . 0.0 110.497 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.76 -16.07 54.79 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.529 0.331 . . . . 0.0 111.332 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.4 tp -79.53 -2.21 41.2 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 122.897 0.479 . . . . 0.0 111.952 -177.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.8 t -147.86 -16.78 0.36 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.907 -0.496 . . . . 0.0 112.333 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.33 11.55 85.4 Favored Glycine 0 CA--C 1.527 0.798 0 O-C-N 121.67 -0.644 . . . . 0.0 113.138 173.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.9 m -142.8 123.26 13.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.141 0.97 . . . . 0.0 110.12 -178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -66.73 -24.1 66.19 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.762 -177.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -68.72 -39.13 80.57 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.1 0.409 . . . . 0.0 110.891 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -82.36 -31.79 29.59 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -64.74 -43.72 95.85 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -69.57 -33.67 73.06 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.428 0.614 . . . . 0.0 110.546 178.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -67.3 -45.63 75.96 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 122.543 0.337 . . . . 0.0 110.968 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -64.13 -34.41 77.99 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 118.035 0.38 . . . . 0.0 111.032 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.36 -55.07 26.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 117.812 0.278 . . . . 0.0 111.116 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.1 ttp180 -75.51 -27.12 58.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.01 -176.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.02 -26.74 64.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 117.499 0.136 . . . . 0.0 110.758 176.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.8 m -65.87 -38.09 87.88 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.4 OUTLIER -73.7 -43.19 59.97 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -61.98 -18.57 60.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.848 0.459 . . . . 0.0 110.96 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -86.77 0.3 55.01 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.077 0.551 . . . . 0.0 112.078 177.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 77.6 mt -120.68 -20.9 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 122.724 0.41 . . . . 0.0 111.407 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.9 m -65.88 -4.5 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-N 118.832 0.742 . . . . 0.0 112.326 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -125.12 3.64 7.92 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.647 0.779 . . . . 0.0 110.31 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.0 56.29 1.26 Allowed Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.648 0.779 . . . . 0.0 110.303 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -64.99 -10.96 27.52 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.005 2.47 . . . . 0.0 111.782 -176.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -71.26 -16.46 62.48 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.968 -0.457 . . . . 0.0 110.479 175.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -84.5 3.07 38.11 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.005 0.522 . . . . 0.0 110.909 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.482 ' CZ ' HD21 ' A' ' 7' ' ' LEU . 30.2 t80 -129.36 68.17 79.81 Favored Pre-proline 0 N--CA 1.454 -0.244 0 C-N-CA 122.408 0.283 . . . . 0.0 110.783 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.03 167.71 24.01 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.827 3.018 . . . . 0.0 110.746 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.2 11.28 11.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.585 0.754 . . . . 0.0 109.77 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.82 7.55 3.05 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.072 0.949 . . . . 0.0 111.558 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 32.6 m -134.92 177.41 6.87 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 123.777 0.831 . . . . 0.0 109.911 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -59.32 151.23 59.99 Favored Pre-proline 0 N--CA 1.455 -0.22 0 C-N-CA 122.43 0.292 . . . . 0.0 110.291 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -70.64 12.71 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 124.063 3.176 . . . . 0.0 111.629 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -133.52 -17.61 2.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.438 0.695 . . . . 0.0 111.734 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 41.8 tp -74.45 -31.65 62.33 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.565 0.621 . . . . 0.0 110.198 178.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -75.91 -26.41 64.71 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -67.34 -42.17 83.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -79.87 -32.58 40.41 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.562 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -63.72 -44.81 92.51 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-N 118.632 0.651 . . . . 0.0 111.448 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.3 mmm -76.73 -33.4 58.15 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.01 -176.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -69.88 -33.31 72.07 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.477 177.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -67.53 -29.02 68.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.29 -37.98 71.19 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 49.5 mm -72.21 -38.25 61.71 Favored 'Isoleucine or valine' 0 C--O 1.23 0.074 0 CA-C-N 117.692 0.746 . . . . 0.0 110.267 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -69.52 -33.76 73.28 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.264 -0.272 . . . . 0.0 110.554 -179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.05 -33.11 73.06 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.106 -0.371 . . . . 0.0 110.262 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.2 t -73.06 -25.71 61.02 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.15 -36.5 61.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.169 0.187 . . . . 0.0 110.594 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -75.64 -23.86 56.38 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 122.3 -0.25 . . . . 0.0 110.452 176.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -72.6 2.14 6.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.262 0.625 . . . . 0.0 111.869 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -140.11 3.85 2.01 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.038 0.535 . . . . 0.0 111.001 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 72.19 13.95 76.57 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.82 -0.433 . . . . 0.0 112.524 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -69.14 -6.11 26.56 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 117.675 0.737 . . . . 0.0 111.454 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.28 159.83 43.2 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 122.062 -0.399 . . . . 0.0 110.69 -179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.7 mm-40 -148.69 -166.67 2.61 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.973 1.309 . . . . 0.0 108.76 -176.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 15.1 t -57.63 173.23 0.3 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.116 0.566 . . . . 0.0 110.617 174.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.6 p -138.14 171.54 14.25 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 121.26 0.552 . . . . 0.0 111.996 -173.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -145.5 16.72 1.48 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.713 0.805 . . . . 0.0 110.67 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.6 m 61.77 179.06 0.12 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.465 1.106 . . . . 0.0 112.642 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -141.39 25.78 2.02 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.882 0.473 . . . . 0.0 111.394 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -123.64 -173.63 2.79 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.714 0.806 . . . . 0.0 109.928 179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.8 8.0 3.26 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -177.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -173.27 10.29 0.04 OUTLIER Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.643 -0.789 . . . . 0.0 114.446 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.6 t -148.38 9.09 0.83 Allowed 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.52 1.16 . . . . 0.0 112.269 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -154.02 -41.79 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 121.988 -0.445 . . . . 0.0 109.99 174.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.19 -23.09 64.8 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 121.65 -0.656 . . . . 0.0 109.808 174.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.43 -26.1 38.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 122.446 0.299 . . . . 0.0 110.364 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.64 -3.76 54.33 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.184 0.594 . . . . 0.0 111.845 -179.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -129.75 -13.07 4.24 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.07 -1.92 31.47 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.098 0.559 . . . . 0.0 110.794 175.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.48 ' C ' HD22 ' A' ' 91' ' ' LEU . 86.6 mtt-85 -126.49 -15.62 5.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.489 0.716 . . . . 0.0 110.594 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.48 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.1 mm? -135.96 38.89 2.78 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.782 1.233 . . . . 0.0 110.204 -176.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.33 2.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -130.42 7.81 4.97 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.916 0.78 . . . . 0.0 112.333 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 tpp -61.86 142.78 57.16 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 118.014 0.37 . . . . 0.0 110.034 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.5 m -64.07 137.88 97.24 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.091 0.556 . . . . 0.0 109.665 178.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -68.81 5.5 1.33 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.905 3.07 . . . . 0.0 113.394 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -127.54 -33.67 2.3 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.5 m -67.84 -24.16 65.24 Favored 'General case' 0 C--N 1.337 0.057 0 O-C-N 121.858 -0.526 . . . . 0.0 109.951 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.7 ttm-85 -67.09 -32.52 73.74 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.671 0.388 . . . . 0.0 110.195 174.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -74.51 -37.48 63.09 Favored 'General case' 0 N--CA 1.456 -0.153 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.34 -34.07 75.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 122.184 -0.322 . . . . 0.0 110.285 177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.2 tp -65.96 -42.59 89.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 122.676 0.39 . . . . 0.0 110.947 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.13 -6.68 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.712 -0.617 . . . . 0.0 111.347 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -97.94 -4.9 35.45 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 175.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 69.4 p -134.84 3.37 3.22 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -140.16 10.43 2.35 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.246 0.475 . . . . 0.0 112.084 177.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.435 ' SD ' ' HB3' ' B' ' 32' ' ' LEU . 2.4 mtm -137.49 -8.9 1.69 Allowed 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -150.27 -9.01 0.28 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.012 0.824 . . . . 0.0 112.683 177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 69.51 23.07 76.71 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.084 -0.842 . . . . 0.0 113.738 173.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -56.19 150.83 13.5 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.709 1.254 . . . . 0.0 109.98 176.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.4 m -66.07 155.61 86.75 Favored Pre-proline 0 N--CA 1.454 -0.236 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.3 -19.62 43.72 Favored 'Trans proline' 0 N--CA 1.451 -1.006 0 C-N-CA 122.382 2.055 . . . . 0.0 111.357 -178.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -73.57 -33.49 64.68 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.997 -0.439 . . . . 0.0 110.224 176.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -83.4 -37.91 22.65 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.31 0.244 . . . . 0.0 110.434 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.11 -27.4 68.72 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 122.213 -0.304 . . . . 0.0 111.03 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.16 -32.07 33.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 117.688 0.222 . . . . 0.0 110.721 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -71.4 -30.55 66.24 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.134 0.574 . . . . 0.0 110.836 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 58.6 mt -74.14 -5.77 43.72 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 176.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.0 pt -135.38 11.57 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 118.725 0.693 . . . . 0.0 111.289 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 55.06 54.55 8.76 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.516 1.126 . . . . 0.0 114.016 176.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 27.9 m -136.06 176.07 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.111 0.564 . . . . 0.0 110.266 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -74.38 157.3 35.93 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 88.4 m -60.97 -36.23 78.86 Favored 'General case' 0 N--CA 1.457 -0.106 0 O-C-N 122.193 -0.317 . . . . 0.0 110.81 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 95.6 p -75.94 -21.17 57.32 Favored 'General case' 0 N--CA 1.456 -0.162 0 O-C-N 122.063 -0.398 . . . . 0.0 111.134 -179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -74.67 -43.29 55.98 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.087 -0.383 . . . . 0.0 110.413 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.8 p -66.63 -31.5 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 C-N-CA 119.481 -0.888 . . . . 0.0 110.063 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -63.67 -34.11 77.12 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 175.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.8 m -77.13 -37.59 53.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.222 -0.299 . . . . 0.0 110.422 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.03 -33.79 76.88 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 119.474 -0.298 . . . . 0.0 111.383 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.8 m -82.12 -26.86 9.21 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 118.314 0.506 . . . . 0.0 111.096 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.5 m -67.59 -38.5 84.12 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -78.34 -25.2 46.34 Favored 'General case' 0 N--CA 1.455 -0.2 0 O-C-N 122.263 -0.273 . . . . 0.0 110.5 177.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.72 48.61 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 117.744 0.247 . . . . 0.0 110.342 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -69.79 -22.21 63.34 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 122.084 -0.385 . . . . 0.0 110.968 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.1 -36.41 69.45 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 122.387 -0.196 . . . . 0.0 110.967 176.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -83.79 -16.8 43.31 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.759 -0.588 . . . . 0.0 111.094 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 9.4 mm -62.24 -52.63 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 171.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.53 -17.31 60.76 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -69.88 -15.6 63.1 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -147.47 -44.4 0.17 Allowed 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 47.6 p 44.72 -12.3 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 118.759 2.874 . . . . 0.0 118.759 -177.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.19 7.09 0.09 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 121.354 1.888 . . . . 0.0 113.617 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.08 -173.92 4.37 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.899 0.48 . . . . 0.0 110.024 -175.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.404 HD23 ' H ' ' A' ' 144' ' ' LEU . 1.7 pt? -149.48 168.51 23.26 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.229 0.612 . . . . 0.0 110.472 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -155.0 164.22 39.21 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -178.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 41.0 tp -62.36 141.48 58.29 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.219 0.607 . . . . 0.0 110.149 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 18.5 m -147.99 152.56 40.47 Favored Pre-proline 0 C--O 1.232 0.163 0 C-N-CA 123.023 0.529 . . . . 0.0 110.074 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -75.46 -1.64 11.57 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 124.107 3.205 . . . . 0.0 112.157 177.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 -76.75 6.86 5.34 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 162.99 4.88 0.04 OUTLIER Glycine 0 CA--C 1.526 0.749 0 CA-C-O 118.935 -0.925 . . . . 0.0 114.296 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 39.8 m -142.31 2.44 1.47 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.957 1.379 . . . . 0.0 113.01 -176.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 39.5 t-80 -154.38 165.12 37.38 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.281 0.491 . . . . 0.0 110.316 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 25.7 p80 -157.5 167.85 29.0 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.095 0.558 . . . . 0.0 110.42 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 27.8 p80 -155.98 172.52 18.25 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.158 0.583 . . . . 0.0 110.262 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -146.06 22.01 1.39 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.374 0.669 . . . . 0.0 111.185 -176.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -140.5 20.38 2.38 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.738 0.415 . . . . 0.0 111.676 -174.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 . . . . . 0 C--O 1.251 1.167 0 CA-C-O 117.739 -1.124 . . . . 0.0 110.748 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 16.2 tpt . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 54.5 tp -152.87 -26.88 0.15 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.626 0.371 . . . . 0.0 110.781 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -151.82 -7.33 0.23 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.703 0.401 . . . . 0.0 111.577 178.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -155.52 150.44 20.63 Favored Pre-proline 0 N--CA 1.453 -0.29 0 C-N-CA 123.493 0.717 . . . . 0.0 110.594 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.19 5.96 5.04 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 124.601 3.534 . . . . 0.0 112.616 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -128.05 -166.51 12.06 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 -174.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -141.34 172.97 11.95 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.715 0.806 . . . . 0.0 110.392 -177.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -139.75 10.21 2.43 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.07 0.548 . . . . 0.0 111.439 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -150.87 177.36 10.2 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 122.897 0.479 . . . . 0.0 110.553 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -144.85 20.97 1.63 Allowed 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.484 0.713 . . . . 0.0 110.911 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -134.73 2.58 3.18 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.545 0.738 . . . . 0.0 111.623 -177.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -143.81 8.65 1.5 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.623 0.769 . . . . 0.0 110.246 176.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -152.94 171.76 17.83 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.331 1.052 . . . . 0.0 109.237 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 34.3 t -154.05 172.6 17.25 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.02 0.528 . . . . 0.0 110.348 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -138.96 7.79 2.49 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.785 0.834 . . . . 0.0 110.907 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt 51.42 -167.11 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.458 1.103 . . . . 0.0 112.234 -177.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 48.7 m -140.49 54.12 4.68 Favored Pre-proline 0 CA--C 1.53 0.178 0 C-N-CA 123.406 0.682 . . . . 0.0 111.139 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.81 176.58 8.06 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.767 2.978 . . . . 0.0 111.134 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -148.66 168.09 23.76 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.447 0.699 . . . . 0.0 110.406 179.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -155.58 153.66 30.49 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 30.9 m -145.25 -173.7 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 C-N-CA 123.897 0.879 . . . . 0.0 109.632 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mp0 -131.28 1.79 4.2 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.825 0.45 . . . . 0.0 111.697 -176.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 25.2 m 51.11 21.32 1.02 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.111 0.965 . . . . 0.0 113.43 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -139.6 6.97 2.3 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.63 0.772 . . . . 0.0 110.871 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -72.01 2.11 6.22 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.531 0.732 . . . . 0.0 111.527 177.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.414 ' HG2' ' H ' ' B' ' 28' ' ' MET . 43.0 ttm180 -58.28 143.0 46.13 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.685 0.794 . . . . 0.0 110.303 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -68.2 -8.97 43.49 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . 0.414 ' H ' ' HG2' ' B' ' 26' ' ' ARG . 17.6 tpt -63.08 -25.76 68.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 117.908 0.322 . . . . 0.0 111.46 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.64 -36.02 58.72 Favored Glycine 0 C--N 1.339 0.706 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.71 -16.04 62.22 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 122.238 -0.566 . . . . 0.0 111.014 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.12 -39.24 18.14 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.435 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 63.2 mt -74.43 -38.07 63.13 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.937 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -68.26 -33.69 74.83 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-O 119.175 -0.44 . . . . 0.0 110.471 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 48.5 t -66.24 -36.5 83.17 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 118.665 0.666 . . . . 0.0 110.622 178.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.65 -32.09 73.47 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.584 0.231 . . . . 0.0 111.014 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -97.96 -11.38 23.14 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 68.7 tp60 -71.36 -36.68 71.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 121.899 -0.501 . . . . 0.0 110.196 176.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -64.63 -24.35 67.56 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 120.311 -0.555 . . . . 0.0 110.835 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 13.1 m -70.17 -12.62 61.73 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 111.382 0.141 . . . . 0.0 111.382 174.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 67.6 mt -107.16 -18.05 7.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 O-C-N 121.96 -0.463 . . . . 0.0 110.785 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.51 26.64 0.1 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.575 0.75 . . . . 0.0 112.054 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -142.06 176.5 8.91 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.058 0.543 . . . . 0.0 111.151 -178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -63.35 175.31 1.01 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.865 0.866 . . . . 0.0 111.362 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.94 155.12 80.51 Favored Pre-proline 0 CA--C 1.53 0.204 0 C-N-CA 122.407 0.283 . . . . 0.0 110.481 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . 0.451 ' C ' ' H ' ' B' ' 47' ' ' GLU . 51.5 Cg_exo -54.79 -39.55 89.15 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.681 2.921 . . . . 0.0 114.952 -174.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.8 t70 51.37 -11.18 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.473 1.909 . . . . 0.0 115.286 -174.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.451 ' H ' ' C ' ' B' ' 45' ' ' PRO . 14.1 pt-20 -66.53 -16.51 64.2 Favored 'General case' 0 N--CA 1.457 -0.11 0 O-C-N 121.131 -0.981 . . . . 0.0 111.65 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 29.6 mtm -73.3 -32.25 64.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 122.274 -0.266 . . . . 0.0 111.044 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -84.24 -12.27 55.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.793 -0.567 . . . . 0.0 110.018 173.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.21 -20.61 62.24 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.837 -0.539 . . . . 0.0 109.649 169.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 75.9 mt -78.55 -13.58 59.76 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.337 0.255 . . . . 0.0 110.406 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -88.13 -16.0 34.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 171.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -75.55 6.85 4.22 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.845 0.858 . . . . 0.0 111.675 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -127.66 9.77 6.53 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 123.732 0.813 . . . . 0.0 111.566 -178.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 4.1 pp -145.21 -17.33 0.49 Allowed 'General case' 0 C--N 1.339 0.133 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.44 170.28 9.28 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.807 0.337 . . . . 0.0 110.78 173.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 47.5 tp -152.06 158.79 43.51 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -142.76 162.14 36.25 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.055 0.542 . . . . 0.0 109.771 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 22.5 tp -152.32 7.72 0.45 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 122.756 0.422 . . . . 0.0 110.896 -179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.6 p -150.59 142.38 15.49 Favored Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -177.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.32 177.8 6.24 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.393 2.728 . . . . 0.0 111.351 176.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 . . . . . 0 CA--C 1.532 0.27 0 C-N-CA 124.59 1.156 . . . . 0.0 111.817 -177.647 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.2 ptm . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 120.366 0.127 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.9 t -154.15 164.71 38.07 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 122.867 0.467 . . . . 0.0 109.879 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.3 tp -59.22 -28.57 66.8 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.038 0.535 . . . . 0.0 110.967 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.45 -31.5 80.97 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.938 -0.465 . . . . 0.0 111.938 -178.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -77.17 1.42 18.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 122.719 0.408 . . . . 0.0 111.265 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -133.07 3.57 3.71 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.189 0.595 . . . . 0.0 110.695 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.6 tp -111.69 -41.1 4.13 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 122.542 0.337 . . . . 0.0 110.45 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.415 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.16 -45.23 99.88 Favored Pre-proline 0 N--CA 1.451 -0.386 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 98.9 Cg_endo -74.86 -0.39 9.84 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.431 2.087 . . . . 0.0 112.774 -176.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -135.13 14.04 3.55 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 68.3 mt -54.33 -44.31 98.57 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-O 118.393 -0.813 . . . . 0.0 112.574 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -81.47 -10.01 12.25 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.07 1.847 . . . . 0.0 112.672 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -66.57 -24.52 66.36 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 118.646 0.657 . . . . 0.0 110.621 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.2 mt -67.4 -18.92 65.31 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.67 0.271 . . . . 0.0 110.442 176.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -98.81 -14.65 19.58 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.462 0.705 . . . . 0.0 110.276 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.8 ttp180 -62.41 -16.24 53.78 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.438 0.695 . . . . 0.0 111.097 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -141.59 -21.02 0.74 Allowed 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 173.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -70.52 -23.24 77.76 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 65.0 ttp85 -71.87 -10.02 59.16 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 117.657 0.729 . . . . 0.0 111.647 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -129.08 6.1 5.39 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.74 0.416 . . . . 0.0 111.466 -177.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -91.95 -0.96 57.5 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.098 0.559 . . . . 0.0 110.437 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.2 t -151.37 -4.95 0.28 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.44 18.08 71.28 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.44 -0.788 . . . . 0.0 114.096 173.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.8 t -143.81 131.24 21.0 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 118.344 1.072 . . . . 0.0 110.16 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 -74.67 -22.94 58.6 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.181 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -76.57 -35.53 58.13 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -73.88 -35.77 64.74 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.0 -36.57 86.38 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -69.64 -35.69 75.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 117.222 0.511 . . . . 0.0 111.323 179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.43 -29.8 24.07 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.753 -176.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -65.18 -35.98 82.79 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 119.295 0.952 . . . . 0.0 109.427 176.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 24.6 t -62.91 -53.52 45.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 C-N-CA 122.338 0.255 . . . . 0.0 110.687 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -71.58 -28.12 63.61 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.43 -175.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.02 -21.59 59.91 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 122.201 0.2 . . . . 0.0 110.748 176.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 81.6 m -66.37 -44.88 81.92 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.0 -38.1 64.2 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.964 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -67.32 -14.56 63.03 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.803 -0.561 . . . . 0.0 110.923 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.4 0.4 56.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.324 0.65 . . . . 0.0 111.216 174.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 88.3 mt -123.57 -14.27 5.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 123.523 0.729 . . . . 0.0 111.358 -174.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -60.07 -4.79 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 121.503 -0.748 . . . . 0.0 112.964 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -124.3 2.1 8.46 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.024 0.53 . . . . 0.0 111.143 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.32 54.74 0.86 Allowed Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 123.651 0.781 . . . . 0.0 110.544 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.7 -13.04 36.83 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 123.435 2.757 . . . . 0.0 113.049 -174.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -74.99 -14.97 60.68 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.463 0.305 . . . . 0.0 111.213 177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -77.74 -19.79 54.56 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.007 -0.433 . . . . 0.0 111.016 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.46 114.55 52.33 Favored Pre-proline 0 N--CA 1.452 -0.345 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 178.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.87 155.09 71.12 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.526 2.151 . . . . 0.0 110.986 -176.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.7 mmt85 -136.8 12.85 3.15 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.771 0.828 . . . . 0.0 110.772 -174.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -134.73 27.93 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.343 0.657 . . . . 0.0 111.041 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.6 m -134.76 179.15 4.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 C-N-CA 123.828 0.851 . . . . 0.0 109.207 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -54.43 146.72 31.79 Favored Pre-proline 0 CA--C 1.531 0.212 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -70.79 9.71 0.73 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 123.826 3.017 . . . . 0.0 111.722 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -129.37 -16.88 3.85 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.5 0.72 . . . . 0.0 110.933 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.8 tp -78.84 -34.17 45.37 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.165 0.439 . . . . 0.0 110.303 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.64 -31.28 60.79 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 110.339 -1.104 . . . . 0.0 110.339 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.54 -47.67 77.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.4 m-30 -74.75 -30.0 61.34 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 119.698 -0.191 . . . . 0.0 111.485 -177.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.2 tpt180 -63.05 -45.91 89.99 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 118.382 0.537 . . . . 0.0 110.605 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 92.9 mmm -73.54 -31.3 63.58 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.829 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.37 -37.9 74.65 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.036 0.38 . . . . 0.0 111.016 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -65.71 -24.82 67.07 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -71.29 -37.22 63.24 Favored Glycine 0 C--N 1.339 0.721 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 177.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.5 mm -73.19 -39.93 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.096 0 CA-C-N 117.709 0.755 . . . . 0.0 110.432 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 70.2 t90 -68.27 -33.64 74.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.293 -0.254 . . . . 0.0 111.122 -177.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.32 -31.54 68.89 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 117.78 0.264 . . . . 0.0 110.433 176.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.2 t -75.97 -26.1 56.46 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.146 0.178 . . . . 0.0 110.835 177.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.58 -36.79 68.26 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.382 0.273 . . . . 0.0 110.991 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -77.15 -22.81 52.0 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.55 3.64 18.21 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.259 0.624 . . . . 0.0 111.747 177.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -138.86 2.91 2.2 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.846 0.458 . . . . 0.0 111.242 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.43 26.62 72.95 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-O 119.684 -0.509 . . . . 0.0 113.133 175.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -63.63 -10.15 17.3 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.164 0.982 . . . . 0.0 112.249 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.65 158.5 38.42 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.057 0.543 . . . . 0.0 110.363 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -144.52 5.73 1.23 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.344 0.657 . . . . 0.0 110.769 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.0 t -156.69 178.09 10.73 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.071 0.548 . . . . 0.0 109.956 -177.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.5 p -145.43 17.24 1.51 Allowed 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 123.528 0.731 . . . . 0.0 110.619 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -56.42 150.32 15.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.11 0.564 . . . . 0.0 110.278 177.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -144.84 -176.27 5.01 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.22 0.608 . . . . 0.0 109.855 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -141.21 13.12 2.2 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.782 0.433 . . . . 0.0 111.697 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.82 156.92 13.2 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.062 -0.398 . . . . 0.0 110.835 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -79.42 -11.94 59.91 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -175.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 156.19 26.04 0.03 OUTLIER Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.305 -0.719 . . . . 0.0 113.787 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.7 t -138.05 13.48 2.86 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.602 1.201 . . . . 0.0 112.111 -177.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -155.16 -50.04 0.09 Allowed 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -20.75 64.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.477 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.5 p -67.56 -29.96 47.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 C-N-CA 122.465 0.306 . . . . 0.0 110.828 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.23 -2.05 54.63 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 122.822 0.449 . . . . 0.0 111.564 -178.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -116.04 -44.62 2.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.58 0.352 . . . . 0.0 110.776 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.7 -1.61 1.99 Allowed 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.468 ' C ' HD22 ' A' ' 91' ' ' LEU . 82.6 mtt-85 -120.82 -15.38 8.36 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.424 0.69 . . . . 0.0 111.516 178.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.468 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.1 mm? -134.32 28.23 3.73 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.909 0.884 . . . . 0.0 110.626 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.88 1.07 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 -176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 44.1 tpt85 -130.85 0.29 4.29 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 118.641 0.655 . . . . 0.0 112.097 -175.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.7 ttm -59.14 152.02 21.35 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.6 m -53.46 137.76 50.69 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 123.172 0.589 . . . . 0.0 110.548 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.95 -5.43 0.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 125.083 3.855 . . . . 0.0 115.9 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 21.7 tp -133.57 -23.49 1.84 Allowed 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.834 0.743 . . . . 0.0 111.898 -178.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 48.2 m -68.74 -24.7 64.49 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.639 0.654 . . . . 0.0 109.878 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 69.3 ttt-85 -73.07 -27.78 61.93 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -78.27 -35.24 48.35 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.84 74.59 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 49.3 tp -65.76 -49.78 67.13 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.395 0.278 . . . . 0.0 110.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.26 -4.55 33.81 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 115' ' ' ALA . 19.1 tp -106.15 -4.59 20.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.09 0.556 . . . . 0.0 111.72 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 77.3 p -140.06 3.28 1.98 Allowed 'General case' 0 C--N 1.34 0.189 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -130.52 6.2 4.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.324 0.511 . . . . 0.0 112.147 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 1.4 mtm -127.38 -7.7 5.81 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.927 0.491 . . . . 0.0 111.887 176.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -150.65 -22.9 0.23 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.744 0.702 . . . . 0.0 112.103 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 79.05 28.05 54.87 Favored Glycine 0 CA--C 1.528 0.905 0 CA-C-O 119.218 -0.768 . . . . 0.0 113.426 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -51.25 149.22 4.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.275 1.037 . . . . 0.0 110.659 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 49.0 m -62.16 152.54 77.99 Favored Pre-proline 0 N--CA 1.456 -0.143 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -69.78 -17.02 37.73 Favored 'Trans proline' 0 N--CA 1.452 -0.941 0 C-N-CA 122.996 2.464 . . . . 0.0 111.945 -176.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -78.98 -41.34 29.31 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 118.029 0.377 . . . . 0.0 110.368 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.4 m-20 -78.7 -30.51 46.05 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.425 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -68.49 -25.36 64.93 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 175.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.05 -27.75 35.61 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.125 0.17 . . . . 0.0 110.757 178.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -70.45 -33.42 71.27 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.036 0.535 . . . . 0.0 111.628 179.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 77.7 mt -74.02 -4.29 34.46 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.411 HG13 HG22 ' A' ' 121' ' ' VAL . 28.6 pt -135.92 9.22 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 118.306 0.503 . . . . 0.0 110.978 177.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 50.08 61.04 3.39 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.136 1.374 . . . . 0.0 113.935 178.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 119' ' ' ILE . 22.3 m -134.69 -175.51 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 C-N-CA 123.854 0.862 . . . . 0.0 109.792 175.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -89.65 159.66 17.02 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 18.0 m -56.51 -39.11 72.75 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 122.565 0.346 . . . . 0.0 111.416 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.2 m -70.82 -20.57 62.55 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.868 0.467 . . . . 0.0 112.034 -177.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -73.98 -40.7 62.79 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.5 t -63.45 -38.22 81.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.12 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -60.56 -38.44 84.55 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.48 0.181 . . . . 0.0 110.856 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.3 m -76.12 -37.71 57.75 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.905 -0.134 . . . . 0.0 110.772 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 71.5 mt -66.82 -34.09 77.04 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 119.537 -0.268 . . . . 0.0 111.415 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 m -81.34 -28.44 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.075 0 CA-C-N 118.452 0.569 . . . . 0.0 111.028 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 55.4 m -66.22 -40.52 90.36 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -76.49 -28.16 56.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -71.4 -44.11 65.56 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.344 -0.222 . . . . 0.0 111.246 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -73.61 -22.83 59.9 Favored 'General case' 0 N--CA 1.454 -0.232 0 O-C-N 122.15 -0.344 . . . . 0.0 111.026 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.17 -42.63 72.2 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.611 0.187 . . . . 0.0 110.935 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -77.75 -17.8 57.17 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.151 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 12.5 mm -73.94 -53.93 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 173.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -69.43 -17.12 63.62 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -173.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 pttp -85.69 -10.84 55.06 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.478 ' HG3' ' H ' ' A' ' 142' ' ' ARG . 18.8 pt20 -156.69 -36.35 0.08 Allowed 'General case' 0 C--N 1.339 0.145 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -176.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 43.0 p 44.39 19.43 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.341 1.056 . . . . 0.0 112.852 -169.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.478 ' H ' ' HG3' ' A' ' 140' ' ' GLN . 34.6 mtp-105 -147.86 168.0 23.34 Favored 'General case' 0 N--CA 1.457 -0.094 0 C-N-CA 124.036 0.935 . . . . 0.0 110.357 -171.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -151.3 13.29 0.66 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.083 0.553 . . . . 0.0 110.684 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.8 -9.34 58.55 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.275 0.63 . . . . 0.0 112.427 -174.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -150.94 2.7 0.44 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.629 0.65 . . . . 0.0 112.65 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -155.8 165.27 37.0 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 122.835 0.454 . . . . 0.0 110.566 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 21.1 m -148.28 158.79 40.7 Favored Pre-proline 0 CA--C 1.53 0.203 0 C-N-CA 123.23 0.612 . . . . 0.0 109.76 179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -51.17 177.51 0.04 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 1 C-N-CA 125.522 4.148 . . . . 0.0 113.432 169.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 17.8 ptm180 -143.47 178.84 7.49 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 123.056 0.542 . . . . 0.0 110.744 -178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -163.41 -174.45 33.29 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 82.8 p -145.83 11.14 1.23 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.625 0.37 . . . . 0.0 111.872 -177.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 56.0 p-80 -61.64 165.34 5.12 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 122.913 0.485 . . . . 0.0 110.885 178.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -152.84 179.12 8.94 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.577 0.351 . . . . 0.0 110.322 -177.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 53.5 m80 -138.37 16.98 2.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.373 0.669 . . . . 0.0 111.354 -176.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -145.26 172.63 12.86 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.162 0.585 . . . . 0.0 109.542 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 63.3 m80 -143.67 -178.8 6.08 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 122.99 0.516 . . . . 0.0 110.874 -173.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.027 -1.464 . . . . 0.0 110.009 -178.326 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.576 ' HG3' ' H ' ' B' ' 2' ' ' LEU . 14.7 ptm . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 118.729 -0.653 . . . . 0.0 111.285 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . 0.576 ' H ' ' HG3' ' B' ' 1' ' ' MET . 2.3 pt? -153.1 8.87 0.42 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.181 0.9 . . . . 0.0 112.555 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.429 ' C ' HD22 ' B' ' 4' ' ' LEU . 4.8 p-10 -151.06 168.92 23.13 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.935 0.494 . . . . 0.0 110.594 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.429 HD22 ' C ' ' B' ' 3' ' ' ASP . 3.5 mm? -129.33 156.24 78.75 Favored Pre-proline 0 CA--C 1.531 0.244 0 C-N-CA 124.038 0.935 . . . . 0.0 109.014 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.96 171.2 17.12 Favored 'Trans proline' 0 N--CA 1.454 -0.825 0 C-N-CA 123.48 2.787 . . . . 0.0 110.957 177.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -166.59 3.69 0.05 OUTLIER Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.918 -0.379 . . . . 0.0 112.742 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -72.52 -2.51 19.98 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 117.691 0.746 . . . . 0.0 111.59 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -151.01 152.66 33.82 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.456 0.702 . . . . 0.0 109.216 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -151.88 20.43 0.69 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 122.644 0.377 . . . . 0.0 111.297 -176.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -59.86 146.68 41.15 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.971 0.509 . . . . 0.0 111.102 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -142.56 22.8 1.98 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.414 1.086 . . . . 0.0 110.462 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.21 9.84 0.76 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.891 1.276 . . . . 0.0 113.579 -177.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 32.4 t -158.27 150.18 21.62 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 176.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 46.6 m 47.57 16.47 0.07 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.013 1.325 . . . . 0.0 114.103 -177.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -144.68 24.3 1.54 Allowed 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.153 0.981 . . . . 0.0 110.147 -176.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -142.24 168.33 19.98 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 123.181 0.592 . . . . 0.0 110.824 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 49.5 m -146.99 54.61 2.07 Favored Pre-proline 0 CA--C 1.532 0.278 0 C-N-CA 123.288 0.635 . . . . 0.0 111.582 -176.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -69.85 171.47 14.49 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.427 2.751 . . . . 0.0 110.912 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -151.7 174.77 13.1 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 122.96 0.504 . . . . 0.0 110.555 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.83 11.92 1.26 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.133 0.573 . . . . 0.0 112.156 -178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 47.2 t -62.81 -18.8 21.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 123.213 0.605 . . . . 0.0 110.841 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -152.32 164.33 37.66 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.164 0.585 . . . . 0.0 109.837 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.2 m -150.52 175.8 11.55 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 123.46 0.704 . . . . 0.0 110.221 -178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -141.53 158.55 43.7 Favored 'General case' 0 C--O 1.231 0.121 0 C-N-CA 123.686 0.795 . . . . 0.0 109.452 178.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -152.65 11.75 0.51 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.543 0.337 . . . . 0.0 111.726 -177.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 149.58 10.66 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 122.775 0.43 . . . . 0.0 111.869 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -153.6 16.6 0.52 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.276 0.63 . . . . 0.0 111.013 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.61 -26.91 62.23 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.098 0.559 . . . . 0.0 112.269 -175.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.93 -42.52 96.84 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.434 -1.066 . . . . 0.0 110.434 177.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.32 -20.44 62.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 122.507 -0.408 . . . . 0.0 110.772 178.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.59 -36.53 70.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 76.8 mt -72.74 -37.43 67.72 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -66.48 -32.63 74.11 Favored 'General case' 0 C--O 1.226 -0.132 0 CA-C-O 119.297 -0.382 . . . . 0.0 110.563 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 57.8 m -66.6 -42.11 87.44 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.651 0.659 . . . . 0.0 110.74 178.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -24.5 64.95 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -179.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -107.73 -13.63 14.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -175.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -68.66 -31.26 70.26 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 170.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -57.5 -37.07 72.37 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 175.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.4 m -68.41 -12.58 61.36 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 177.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 46.6 mm -105.9 -16.02 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 O-C-N 121.803 -0.561 . . . . 0.0 111.259 -178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.92 28.62 0.17 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.252 0.621 . . . . 0.0 110.646 175.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -134.32 173.66 11.38 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.225 0.61 . . . . 0.0 111.309 -174.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -69.12 179.01 2.05 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.023 0.929 . . . . 0.0 110.89 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.4 m -136.82 155.01 76.73 Favored Pre-proline 0 C--O 1.233 0.234 0 C-N-CA 123.376 0.67 . . . . 0.0 110.41 -178.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -77.25 178.74 7.26 Favored 'Trans proline' 0 N--CA 1.453 -0.9 0 C-N-CA 123.691 2.927 . . . . 0.0 110.531 176.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -145.99 -0.44 0.8 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.985 0.514 . . . . 0.0 110.929 175.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -65.15 -24.64 67.46 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 122.912 0.485 . . . . 0.0 112.242 -177.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 53.4 mtm -74.81 -32.78 62.07 Favored 'General case' 0 N--CA 1.455 -0.186 0 O-C-N 122.225 -0.297 . . . . 0.0 110.788 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.5 mt -83.71 -12.65 55.56 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.28 -20.44 61.51 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 69.9 mt -71.0 -18.35 62.6 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.181 -0.324 . . . . 0.0 110.337 172.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 18.5 mt -84.94 -19.15 32.63 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.728 173.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -73.14 8.19 1.76 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.932 0.333 . . . . 0.0 111.039 176.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 61.4 pttt -130.37 12.96 5.54 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.813 0.845 . . . . 0.0 109.986 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.1 mt -131.47 -26.36 2.06 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 123.568 0.747 . . . . 0.0 111.784 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.19 151.97 11.6 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 118.016 0.371 . . . . 0.0 110.511 171.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 39.1 tp -154.38 163.71 39.74 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.195 -0.316 . . . . 0.0 110.605 -176.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -63.41 169.23 3.87 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.101 0.56 . . . . 0.0 111.133 177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 94.8 mt -142.49 172.52 12.58 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.951 0.9 . . . . 0.0 110.165 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 14.5 p -150.02 140.1 13.74 Favored Pre-proline 0 CA--C 1.534 0.334 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.31 171.59 16.63 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 123.268 2.645 . . . . 0.0 111.165 178.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 . . . . . 0 N--CA 1.454 -0.245 0 C-N-CA 123.419 0.687 . . . . 0.0 110.117 -179.592 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.448 ' HG2' ' H ' ' A' ' 3' ' ' LEU . 55.8 ttm . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.8 p -141.41 20.31 2.22 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.475 0.71 . . . . 0.0 110.885 -178.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.448 ' H ' ' HG2' ' A' ' 1' ' ' MET . 49.2 tp -56.72 -33.36 66.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.669 0.788 . . . . 0.0 111.901 -178.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.61 -35.08 91.5 Favored Glycine 0 CA--C 1.526 0.743 0 O-C-N 121.69 -0.631 . . . . 0.0 112.051 -176.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -74.33 3.17 7.77 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.747 0.819 . . . . 0.0 110.94 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.3 mm-40 -131.81 -1.93 3.74 Favored 'General case' 0 N--CA 1.458 -0.059 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 tt -111.37 -43.05 3.76 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.125 0.57 . . . . 0.0 110.624 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.42 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -54.57 -45.2 99.53 Favored Pre-proline 0 CA--C 1.537 0.448 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -175.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 83.9 Cg_endo -75.04 2.26 6.85 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.264 1.976 . . . . 0.0 113.16 -176.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -130.85 9.92 5.0 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.777 0.431 . . . . 0.0 112.02 -177.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 42.9 mt -56.6 -42.35 95.83 Favored Pre-proline 0 CA--C 1.536 0.408 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 178.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.81 -7.53 14.48 Favored 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.922 1.748 . . . . 0.0 112.58 -173.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -71.61 -19.86 62.06 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.542 0.61 . . . . 0.0 111.945 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.402 HD12 ' N ' ' A' ' 14' ' ' LEU . 8.8 mp -77.18 -23.36 51.54 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.815 -0.553 . . . . 0.0 110.886 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -101.78 -15.56 16.9 Favored 'General case' 0 C--O 1.228 -0.027 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -52.48 -27.66 17.15 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.711 1.205 . . . . 0.0 110.884 175.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -137.42 -13.54 1.54 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.568 0.347 . . . . 0.0 111.241 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.44 -34.95 87.51 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.816 -0.914 . . . . 0.0 110.816 178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 47.2 tpt85 -65.44 -20.88 66.55 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.1 0.95 . . . . 0.0 111.369 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.92 -3.6 55.76 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 122.824 0.45 . . . . 0.0 110.906 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mp -111.56 7.77 20.72 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.956 0.902 . . . . 0.0 111.141 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 50.1 p -140.46 -22.43 0.82 Allowed 'General case' 0 C--N 1.338 0.087 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -177.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.43 8.73 60.04 Favored Glycine 0 CA--C 1.529 0.916 0 CA-C-O 119.558 -0.579 . . . . 0.0 112.673 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.5 t -154.51 138.12 16.04 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.331 1.065 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -72.5 -23.19 60.99 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.438 -0.164 . . . . 0.0 110.821 177.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -70.33 -39.06 74.96 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.314 -0.241 . . . . 0.0 110.562 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -82.2 -32.07 30.04 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.07 -43.55 90.27 Favored Glycine 0 C--N 1.337 0.614 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -72.5 -29.4 63.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 117.341 0.57 . . . . 0.0 110.817 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.0 tmmm? -70.7 -44.04 67.77 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.882 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -64.67 -31.9 73.33 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 118.129 0.422 . . . . 0.0 110.91 179.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.4 t -62.08 -52.75 56.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 117.995 0.361 . . . . 0.0 110.935 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 -76.59 -26.77 55.38 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.358 -176.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.38 -24.98 61.34 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 122.284 0.234 . . . . 0.0 110.503 176.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 66.3 m -65.98 -40.15 90.96 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 175.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 -46.64 65.6 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -59.62 -25.32 64.56 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.902 0.481 . . . . 0.0 111.695 -178.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.88 1.0 32.69 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.132 0.573 . . . . 0.0 111.617 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.4 mt -123.8 -16.01 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 123.766 0.826 . . . . 0.0 110.561 -176.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 75.5 t -59.59 -13.92 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 C-N-CA 123.181 0.592 . . . . 0.0 111.641 176.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.44 3.74 9.67 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.063 0.545 . . . . 0.0 111.298 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.31 55.73 1.23 Allowed Pre-proline 0 N--CA 1.452 -0.346 0 C-N-CA 122.935 0.494 . . . . 0.0 110.608 -177.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.45 -8.84 20.21 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 123.109 2.54 . . . . 0.0 112.173 -178.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -78.7 -6.66 56.38 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 122.903 0.481 . . . . 0.0 110.791 174.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 68.1 mm-40 -99.49 8.51 44.46 Favored 'General case' 0 C--N 1.339 0.109 0 C-N-CA 123.511 0.725 . . . . 0.0 110.774 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.415 ' N ' ' HD3' ' A' ' 47' ' ' PRO . 6.3 t80 -134.23 62.06 53.98 Favored Pre-proline 0 CA--C 1.533 0.317 0 C-N-CA 123.064 0.546 . . . . 0.0 109.976 -178.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.415 ' HD3' ' N ' ' A' ' 46' ' ' PHE . 54.4 Cg_exo -52.78 163.69 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 124.701 3.601 . . . . 0.0 114.849 -175.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.401 ' HD3' ' C ' ' A' ' 47' ' ' PRO . 0.5 OUTLIER -121.41 8.99 10.24 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.49 1.116 . . . . 0.0 109.506 177.287 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -76.08 5.25 6.98 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.168 0.987 . . . . 0.0 111.891 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.3 m -136.68 -179.2 2.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 C-N-CA 123.991 0.916 . . . . 0.0 109.347 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.485 ' C ' ' H ' ' A' ' 53' ' ' ARG . 1.8 m-20 -54.46 147.03 30.69 Favored Pre-proline 0 N--CA 1.455 -0.219 0 O-C-N 122.388 -0.195 . . . . 0.0 110.546 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -71.44 18.54 0.27 Allowed 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 124.148 3.232 . . . . 0.0 110.528 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.485 ' H ' ' C ' ' A' ' 51' ' ' ASP . 86.6 mtm180 -131.51 -30.38 1.68 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.001 0.92 . . . . 0.0 110.99 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 62.1 tp -72.01 -39.42 69.22 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 117.682 0.219 . . . . 0.0 110.588 -178.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.68 -29.83 62.84 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.68 -40.9 97.96 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.63 0.372 . . . . 0.0 110.075 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.54 -27.67 41.29 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.4 tpt85 -68.56 -41.45 79.73 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.358 -0.214 . . . . 0.0 110.838 -177.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 98.4 mmm -81.71 -31.24 32.2 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.796 -0.145 . . . . 0.0 110.888 -178.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.4 -37.39 83.04 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -71.87 -24.26 61.64 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.54 -37.69 93.94 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.8 mm -73.78 -35.47 43.49 Favored 'Isoleucine or valine' 0 C--N 1.338 0.104 0 CA-C-N 117.892 0.846 . . . . 0.0 109.882 176.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -65.9 -37.41 86.03 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.382 -0.229 . . . . 0.0 110.382 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.92 -30.27 67.64 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.305 -0.247 . . . . 0.0 110.832 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.3 t -74.89 -28.83 60.79 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 110.618 -0.141 . . . . 0.0 110.618 178.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.54 -31.11 65.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.097 -0.377 . . . . 0.0 110.709 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -83.01 -12.55 57.16 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.539 0.336 . . . . 0.0 110.705 175.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.9 5.84 49.91 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.351 0.66 . . . . 0.0 111.124 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -137.53 0.48 2.27 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.005 0.522 . . . . 0.0 111.133 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.67 6.21 89.11 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.732 -0.482 . . . . 0.0 113.323 176.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -66.49 -20.0 65.93 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.985 0.892 . . . . 0.0 110.621 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -155.99 153.11 29.01 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.818 0.847 . . . . 0.0 109.688 176.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -147.61 -0.59 0.64 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.735 0.414 . . . . 0.0 111.958 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.5 t -160.61 175.47 12.64 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.155 0.434 . . . . 0.0 110.436 -177.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.4 p -153.0 159.82 42.95 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 123.489 0.715 . . . . 0.0 110.121 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -160.91 177.03 10.78 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.277 0.631 . . . . 0.0 109.482 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 57.0 m -141.64 155.43 45.71 Favored 'General case' 0 N--CA 1.457 -0.077 0 C-N-CA 123.296 0.638 . . . . 0.0 109.314 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -152.09 14.04 0.61 Allowed 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -173.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.56 165.97 2.66 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.057 0.456 . . . . 0.0 111.223 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.37 -10.88 55.46 Favored 'General case' 0 CA--C 1.528 0.132 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.52 21.23 0.03 OUTLIER Glycine 0 CA--C 1.526 0.739 0 CA-C-O 119.156 -0.802 . . . . 0.0 113.949 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.7 t -137.11 6.44 2.85 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.715 1.257 . . . . 0.0 112.742 -176.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -143.92 -36.01 0.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 172.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.02 -25.63 66.38 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.6 -24.56 31.32 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 C-N-CA 122.567 0.347 . . . . 0.0 110.517 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.06 -1.4 56.79 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 122.859 0.463 . . . . 0.0 111.814 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -130.41 -16.07 3.53 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 117.804 0.275 . . . . 0.0 111.625 175.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.07 -1.54 32.89 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.771 0.259 . . . . 0.0 110.566 174.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -130.55 -8.54 4.11 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.585 0.754 . . . . 0.0 112.034 -177.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.8 mt -139.58 12.9 2.53 Favored 'General case' 0 C--N 1.342 0.242 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -170.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.54 5.45 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -177.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -130.29 3.73 4.73 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-N 119.12 0.873 . . . . 0.0 112.642 -173.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 52.9 ttm -67.09 158.99 29.77 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 98.0 m -59.01 138.08 87.71 Favored Pre-proline 0 CA--C 1.534 0.364 0 C-N-CA 122.89 0.476 . . . . 0.0 109.944 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 75.5 Cg_exo -52.0 -7.87 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 125.19 3.927 . . . . 0.0 116.335 -178.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.1 tp -131.73 -22.29 2.4 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 119.002 0.819 . . . . 0.0 111.814 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.4 m -66.99 -19.18 65.67 Favored 'General case' 0 N--CA 1.456 -0.167 0 O-C-N 121.929 -0.482 . . . . 0.0 110.059 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -65.87 -34.13 77.43 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.649 0.38 . . . . 0.0 110.25 175.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -80.7 -34.69 34.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.27 -32.38 74.01 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 121.966 -0.459 . . . . 0.0 109.794 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.71 -46.14 73.08 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.004 0.522 . . . . 0.0 110.78 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -74.94 -6.65 50.37 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.353 0.524 . . . . 0.0 111.445 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 74.9 mt -99.79 -6.29 27.19 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.767 0.427 . . . . 0.0 112.0 176.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -135.08 4.72 3.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 118.488 0.585 . . . . 0.0 112.551 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.96 7.93 1.86 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.49 0.316 . . . . 0.0 111.383 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.404 ' SD ' ' HB3' ' B' ' 32' ' ' LEU . 3.1 mtm -141.98 1.83 1.49 Allowed 'General case' 0 C--N 1.338 0.087 0 C-N-CA 123.487 0.715 . . . . 0.0 111.87 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -149.43 -17.93 0.28 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.628 0.649 . . . . 0.0 112.187 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 72.51 10.85 76.15 Favored Glycine 0 CA--C 1.527 0.817 0 CA-C-O 119.282 -0.732 . . . . 0.0 113.401 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -59.73 148.21 35.02 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.819 1.309 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 50.2 m -70.06 152.51 95.8 Favored Pre-proline 0 N--CA 1.452 -0.333 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.29 -24.08 25.75 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 123.208 2.605 . . . . 0.0 113.206 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -73.05 -34.6 66.39 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 122.611 0.364 . . . . 0.0 111.343 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -79.68 -38.28 33.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -67.87 -24.68 65.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.729 -0.177 . . . . 0.0 111.124 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.4 -39.11 65.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.958 0.345 . . . . 0.0 110.507 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -67.38 -26.11 66.3 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.597 176.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 18.4 tp -83.47 -6.2 59.39 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -176.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.411 HG13 HG22 ' A' ' 121' ' ' VAL . 15.7 pt -135.46 11.99 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.645 0.657 . . . . 0.0 111.435 176.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 56.81 53.71 7.95 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.186 0.994 . . . . 0.0 113.524 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.411 HG22 HG13 ' A' ' 119' ' ' ILE . 28.2 m -136.38 178.61 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 C-N-CA 123.443 0.697 . . . . 0.0 110.058 176.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -80.44 157.67 26.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 46.5 m -60.35 -34.4 73.79 Favored 'General case' 0 N--CA 1.455 -0.18 0 O-C-N 121.9 -0.5 . . . . 0.0 110.818 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 84.0 p -72.28 -21.36 61.37 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 122.377 -0.202 . . . . 0.0 111.46 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -74.39 -36.36 63.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.2 t -64.05 -37.69 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.148 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.71 -33.23 73.65 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.2 m -77.31 -38.28 50.89 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 122.341 -0.224 . . . . 0.0 110.795 177.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.2 -35.61 80.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.128 0.422 . . . . 0.0 111.429 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.5 m -76.42 -27.65 17.54 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 CA-C-N 118.805 0.73 . . . . 0.0 110.716 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 52.3 m -67.43 -35.76 79.9 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -81.15 -25.06 37.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 110.589 -0.152 . . . . 0.0 110.589 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.77 -47.34 66.44 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -71.51 -22.43 61.79 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 119.818 -0.135 . . . . 0.0 110.966 179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.51 -36.7 68.42 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -72.85 -25.11 60.99 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 117.668 0.213 . . . . 0.0 110.605 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 20.2 mm -72.83 -54.62 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -61.54 -21.68 64.48 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 122.614 0.366 . . . . 0.0 111.685 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -72.23 -24.58 61.41 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -177.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -154.46 -53.52 0.1 Allowed 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -169.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 22.7 p 46.66 6.24 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -171.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.4 8.91 0.28 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 121.449 1.931 . . . . 0.0 114.441 178.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -142.39 174.26 10.78 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -174.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.417 ' H ' HD23 ' A' ' 144' ' ' LEU . 1.7 pt? -148.34 8.48 0.81 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.132 0.973 . . . . 0.0 110.869 177.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -140.55 21.06 2.37 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.3 1.04 . . . . 0.0 109.953 -179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 40.8 tp -57.32 155.66 8.7 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.169 0.588 . . . . 0.0 110.991 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 16.9 m -141.41 158.61 63.26 Favored Pre-proline 0 N--CA 1.456 -0.127 0 C-N-CA 123.746 0.818 . . . . 0.0 110.03 -176.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.3 -179.54 2.77 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 123.833 3.022 . . . . 0.0 110.755 176.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -137.82 15.72 2.88 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.451 0.701 . . . . 0.0 111.386 -177.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -170.68 -175.3 39.26 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 47.6 m -143.61 174.54 10.69 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.121 0.569 . . . . 0.0 110.208 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 33.6 t-80 -149.06 161.36 42.11 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 122.859 0.464 . . . . 0.0 110.25 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -147.96 175.11 11.25 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.461 0.704 . . . . 0.0 110.474 -176.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -136.3 7.08 3.09 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.156 0.582 . . . . 0.0 111.002 -179.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -156.21 152.74 28.18 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.578 0.751 . . . . 0.0 109.186 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 30.1 p80 -157.8 -5.11 0.09 Allowed 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 85.3 t60 . . . . . 0 C--O 1.251 1.171 0 CA-C-O 117.355 -1.307 . . . . 0.0 110.708 -178.179 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 110.652 -0.129 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.9 -3.82 24.66 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.914 0.485 . . . . 0.0 110.83 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -150.0 174.78 12.33 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.983 0.913 . . . . 0.0 109.816 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 96.7 mt -140.17 159.85 62.38 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 123.329 0.651 . . . . 0.0 110.191 -178.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -53.75 170.67 0.4 Allowed 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 124.834 3.689 . . . . 0.0 114.067 177.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -139.74 4.26 2.7 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.688 178.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -77.64 33.49 0.17 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.914 0.886 . . . . 0.0 110.717 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -134.77 -5.08 2.48 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.675 0.79 . . . . 0.0 111.547 -174.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -158.17 179.91 8.72 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.217 0.607 . . . . 0.0 109.527 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -141.55 12.04 2.11 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 123.172 0.589 . . . . 0.0 110.971 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -144.13 7.9 1.4 Allowed 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -174.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.36 9.01 1.4 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.534 0.606 . . . . 0.0 112.318 -177.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 9.5 t -154.98 -168.76 2.98 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.89 0.476 . . . . 0.0 110.115 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 33.0 t -139.68 170.81 15.21 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.865 0.866 . . . . 0.0 109.857 -178.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -139.1 -8.94 1.32 Allowed 'General case' 0 CA--C 1.528 0.1 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm 44.37 43.47 6.12 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.66 0.784 . . . . 0.0 111.801 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 77.7 p -132.24 61.5 57.87 Favored Pre-proline 0 CA--C 1.533 0.297 0 C-N-CA 123.233 0.613 . . . . 0.0 111.738 -174.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.68 -175.71 0.99 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.931 3.087 . . . . 0.0 110.89 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . 56.84 21.55 6.17 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.079 0.951 . . . . 0.0 112.497 -178.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' B' ' 20' ' ' LYS . 22.1 tptm -76.18 63.85 1.92 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.835 0.854 . . . . 0.0 111.313 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 34.5 m -59.87 178.85 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 123.994 0.917 . . . . 0.0 112.019 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -133.22 12.07 4.21 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.791 0.436 . . . . 0.0 111.644 -174.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.8 p -148.89 165.33 31.85 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 122.988 0.515 . . . . 0.0 110.459 -179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -147.98 -176.3 5.22 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.634 0.774 . . . . 0.0 110.236 -177.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 26.9 t70 55.3 25.36 7.39 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.217 1.007 . . . . 0.0 112.543 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -150.17 173.06 14.34 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.813 0.445 . . . . 0.0 110.838 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -144.86 20.01 1.63 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.214 0.606 . . . . 0.0 111.44 -176.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.6 tpt -55.03 -26.76 39.49 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.925 0.49 . . . . 0.0 112.166 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -71.25 -40.62 60.8 Favored Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.74 -20.3 62.65 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.565 -0.374 . . . . 0.0 110.514 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.4 -37.36 63.42 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.404 ' HB3' ' SD ' ' A' ' 107' ' ' MET . 42.0 mt -77.5 -40.13 43.92 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.521 0.328 . . . . 0.0 110.302 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.46 -34.35 77.73 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.203 -0.311 . . . . 0.0 110.747 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 44.2 t -71.59 -37.36 70.99 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 118.092 0.405 . . . . 0.0 110.851 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.43 -23.87 65.58 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.247 0.219 . . . . 0.0 110.968 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -104.81 -11.75 16.63 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.146 -0.346 . . . . 0.0 111.289 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -66.0 -36.27 82.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 172.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -62.32 -35.76 80.06 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.654 0.381 . . . . 0.0 110.816 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 56.3 m -66.41 -11.82 53.72 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.548 0.574 . . . . 0.0 112.548 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 35.3 pt -129.4 13.16 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.926 -0.484 . . . . 0.0 111.545 -176.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.72 23.53 0.13 Allowed 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.599 0.76 . . . . 0.0 112.188 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.08 -178.53 5.75 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.753 -0.592 . . . . 0.0 111.826 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -63.74 -177.62 0.25 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.386 1.074 . . . . 0.0 112.503 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.6 m -134.3 156.62 78.81 Favored Pre-proline 0 CA--C 1.53 0.175 0 C-N-CA 123.466 0.707 . . . . 0.0 110.276 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.7 178.97 6.7 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 123.1 2.533 . . . . 0.0 110.622 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -146.47 -0.43 0.75 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 122.291 0.236 . . . . 0.0 111.456 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -63.01 -24.53 67.96 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 122.165 -0.334 . . . . 0.0 111.709 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 43.1 mtm -72.85 -29.8 63.49 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.217 0.207 . . . . 0.0 111.328 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.5 -14.37 43.28 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 176.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.1 -20.48 61.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.63 -27.33 62.08 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.499 ' C ' ' H ' ' B' ' 54' ' ' LYS . 22.1 mt -76.69 -15.42 59.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 119.679 -0.201 . . . . 0.0 111.099 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -69.02 16.7 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.331 0.514 . . . . 0.0 111.13 173.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.499 ' H ' ' C ' ' B' ' 52' ' ' LEU . 53.7 mtmt -117.2 -3.77 11.47 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.456 1.102 . . . . 0.0 111.219 176.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -157.58 0.75 0.11 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -135.31 24.22 3.49 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.281 0.632 . . . . 0.0 111.529 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -139.91 134.08 31.1 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -150.0 167.83 25.6 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 123.451 0.7 . . . . 0.0 110.138 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 96.4 mt -141.0 15.12 2.27 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.48 0.712 . . . . 0.0 111.81 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 52.8 t -138.48 135.96 18.59 Favored Pre-proline 0 C--O 1.233 0.192 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.65 160.59 48.93 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 123.191 2.594 . . . . 0.0 111.523 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 41.0 ptt85 . . . . . 0 CA--C 1.528 0.097 0 C-N-CA 123.919 0.888 . . . . 0.0 110.238 -179.111 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.476 0.847 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.5 m 51.1 20.56 0.87 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.482 1.113 . . . . 0.0 113.54 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 42.3 tp -62.54 -27.27 69.05 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.111 -0.368 . . . . 0.0 110.687 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.46 -18.93 79.97 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-O 119.685 -0.508 . . . . 0.0 112.333 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -74.61 -2.31 25.44 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 117.984 0.892 . . . . 0.0 111.636 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -134.31 -21.37 1.82 Allowed 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 123.18 0.592 . . . . 0.0 111.233 178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.4 tp -75.59 -37.44 59.84 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 122.151 -0.343 . . . . 0.0 110.879 175.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.417 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -56.18 -46.75 99.75 Favored Pre-proline 0 CA--C 1.536 0.422 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -173.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.417 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 87.7 Cg_endo -73.0 -3.47 13.69 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.523 2.149 . . . . 0.0 112.968 -177.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -129.22 11.11 5.89 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.311 0.505 . . . . 0.0 111.932 -173.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.62 -46.26 99.85 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -81.21 -9.58 12.67 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 121.995 1.796 . . . . 0.0 112.427 -171.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.5 -32.52 73.45 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 118.505 0.593 . . . . 0.0 110.651 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.3 -18.22 61.81 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 122.368 -0.207 . . . . 0.0 111.047 -177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.6 mtm180 -98.88 -20.52 16.78 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.029 0.377 . . . . 0.0 110.773 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -61.42 -22.38 64.95 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 117.781 0.264 . . . . 0.0 110.74 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -130.34 -13.74 3.86 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.768 0.427 . . . . 0.0 110.876 175.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -60.53 -31.19 73.82 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -68.17 -19.83 64.82 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 117.642 0.721 . . . . 0.0 111.052 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -100.93 4.3 42.47 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.623 0.769 . . . . 0.0 112.28 -175.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 59.9 mt -110.23 5.89 22.16 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 178.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.4 t -154.18 -20.43 0.13 Allowed 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 118.964 0.802 . . . . 0.0 113.133 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.64 2.95 53.03 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-N 118.892 0.769 . . . . 0.0 114.225 174.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 48.2 t -154.82 146.31 23.11 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.658 1.229 . . . . 0.0 111.235 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -77.64 -17.92 57.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.926 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -70.92 -31.02 67.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -82.73 -32.57 27.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 122.798 0.439 . . . . 0.0 110.398 176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.23 -39.94 81.99 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -74.33 -28.39 61.13 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.321 0.561 . . . . 0.0 110.4 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.8 tmmm? -69.26 -42.85 75.04 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.63 -42.14 95.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 119.217 -0.42 . . . . 0.0 111.656 -177.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 34.7 m -67.64 -39.78 82.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.09 0 C-N-CA 119.597 -0.841 . . . . 0.0 111.13 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -77.15 -29.26 54.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.515 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.03 -27.12 61.58 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.1 m -65.64 -40.48 92.56 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 178.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -40.92 26.26 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 121.082 -0.247 . . . . 0.0 111.068 -175.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -65.19 -24.65 67.43 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.221 -178.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.54 -1.16 23.03 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.267 0.627 . . . . 0.0 111.516 175.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 82.0 mt -118.14 -15.72 8.57 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.006 0.922 . . . . 0.0 109.763 -178.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.18 -9.88 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 C-N-CA 123.388 0.675 . . . . 0.0 111.333 175.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.2 -0.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.393 0.677 . . . . 0.0 110.898 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.21 57.51 1.49 Allowed Pre-proline 0 N--CA 1.452 -0.364 0 C-N-CA 123.29 0.636 . . . . 0.0 110.941 -176.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -65.12 -11.0 27.85 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 123.086 2.524 . . . . 0.0 112.237 -177.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.17 -17.63 62.53 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.575 0.35 . . . . 0.0 110.653 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -83.3 0.8 44.13 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.999 0.52 . . . . 0.0 111.197 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -132.61 69.34 79.64 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -177.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.63 177.93 5.0 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 125.014 3.809 . . . . 0.0 112.197 -173.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 43.0 mmm-85 -123.56 7.09 8.89 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.727 0.811 . . . . 0.0 109.999 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -78.67 10.56 3.15 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.375 1.07 . . . . 0.0 111.844 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.5 m -135.47 171.85 16.76 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 C-N-CA 123.64 0.776 . . . . 0.0 109.843 -179.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.96 152.01 52.35 Favored Pre-proline 0 N--CA 1.453 -0.28 0 C-N-CA 122.605 0.362 . . . . 0.0 110.495 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_endo -71.38 12.94 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 124.171 3.248 . . . . 0.0 111.749 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 28.5 mtp180 -131.6 -25.43 2.13 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.321 0.649 . . . . 0.0 110.856 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.3 tp -74.73 -35.94 62.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -74.38 -28.24 64.17 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.47 -46.01 88.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.14 0.576 . . . . 0.0 110.144 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -80.15 -27.01 39.12 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -175.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -65.31 -43.88 89.67 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 118.101 0.41 . . . . 0.0 111.179 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 90.9 mmm -74.4 -32.76 62.81 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.814 -0.355 . . . . 0.0 110.363 -178.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.6 -36.49 78.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.264 -0.273 . . . . 0.0 110.486 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.89 -26.17 66.75 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 122.782 0.433 . . . . 0.0 110.133 177.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.42 -39.89 69.18 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 46.8 mm -74.19 -34.52 37.99 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.075 0 CA-C-N 117.794 0.797 . . . . 0.0 110.238 177.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -66.25 -33.02 74.8 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.438 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.41 -33.03 69.09 Favored 'General case' 0 N--CA 1.456 -0.152 0 O-C-N 122.146 -0.347 . . . . 0.0 110.454 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -70.83 -25.92 63.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.5 -34.11 47.65 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 122.193 0.197 . . . . 0.0 110.717 177.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -71.94 -24.32 61.6 Favored 'General case' 0 C--N 1.34 0.178 0 O-C-N 122.14 -0.35 . . . . 0.0 110.336 174.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.22 0.58 18.63 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.194 0.598 . . . . 0.0 111.584 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -133.55 -1.03 3.16 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.092 0.557 . . . . 0.0 111.457 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.07 -4.72 83.16 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 122.145 -0.347 . . . . 0.0 112.957 177.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -74.07 -6.3 46.71 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -175.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -147.37 22.99 1.17 Allowed 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -78.83 4.2 14.67 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 122.123 -0.361 . . . . 0.0 111.214 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 8.9 t -152.46 168.11 26.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.774 0.83 . . . . 0.0 109.411 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.5 t -156.02 169.94 23.31 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 120.948 0.404 . . . . 0.0 110.844 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -158.55 167.62 29.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.392 1.077 . . . . 0.0 108.821 -178.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -69.55 170.07 11.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.276 0.56 . . . . 0.0 110.562 173.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -141.78 23.5 2.09 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.65 0.78 . . . . 0.0 108.967 178.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.73 -174.16 4.62 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.572 1.149 . . . . 0.0 109.577 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -130.73 11.57 5.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.068 0.547 . . . . 0.0 110.982 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.25 12.37 0.05 OUTLIER Glycine 0 CA--C 1.53 0.995 0 CA-C-O 119.193 -0.782 . . . . 0.0 113.122 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.2 p -138.4 -15.78 1.23 Allowed 'General case' 0 C--N 1.34 0.165 0 CA-C-N 118.373 1.087 . . . . 0.0 113.051 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -137.45 -30.84 0.83 Allowed 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.12 -29.41 70.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 172.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.27 -35.65 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 122.521 0.329 . . . . 0.0 110.179 177.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.27 0.8 54.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.747 0.819 . . . . 0.0 112.319 -174.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.7 ppt_? -129.51 -18.84 3.49 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 118.201 0.455 . . . . 0.0 111.966 176.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.47 -14.54 61.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.047 0.385 . . . . 0.0 111.182 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -130.41 5.28 4.77 Favored 'General case' 0 C--N 1.34 0.187 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.7 mt -138.68 18.8 2.69 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.172 0.589 . . . . 0.0 112.272 -177.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.29 4.87 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -130.1 8.31 5.16 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.801 0.728 . . . . 0.0 111.845 -178.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 60.0 tpp -63.62 150.94 43.0 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.414 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 85.4 m -64.12 139.96 97.79 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 77.8 Cg_exo -52.73 -3.64 0.12 Allowed 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 124.739 3.626 . . . . 0.0 115.937 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -135.11 -24.98 1.4 Allowed 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.317 0.962 . . . . 0.0 112.285 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 90.4 p -69.38 -21.96 63.75 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.061 0.846 . . . . 0.0 109.432 174.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -68.09 -36.83 80.44 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 174.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -74.12 -36.14 64.16 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.18 -32.34 73.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 119.736 -0.173 . . . . 0.0 110.81 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 46.8 tp -64.51 -46.91 80.91 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 6.2 mp -72.87 -11.35 60.56 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.239 -0.288 . . . . 0.0 111.178 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 19.0 tp -97.62 -7.37 31.22 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 p -140.59 0.67 1.66 Allowed 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.63 0.96 6.82 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.719 0.69 . . . . 0.0 111.575 178.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 5.7 ptp -156.29 21.84 0.36 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 177.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -146.27 -23.65 0.44 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.941 0.337 . . . . 0.0 111.798 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 75.03 8.55 83.21 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 118.797 -1.002 . . . . 0.0 114.728 170.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -61.21 145.95 49.4 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.336 1.568 . . . . 0.0 110.439 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 52.1 m -71.16 152.6 94.6 Favored Pre-proline 0 N--CA 1.455 -0.225 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 177.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.76 -27.16 32.94 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.621 2.881 . . . . 0.0 113.945 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -79.37 -39.07 33.47 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 118.061 0.392 . . . . 0.0 111.288 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -78.32 -31.22 48.68 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.27 -26.0 64.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 122.386 0.274 . . . . 0.0 111.063 176.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.56 -33.33 41.89 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 122.386 0.274 . . . . 0.0 110.595 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -70.29 -27.17 64.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.63 0.372 . . . . 0.0 110.764 177.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 19.7 tp -76.68 -8.44 57.27 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.427 HG13 HG22 ' A' ' 121' ' ' VAL . 23.0 pt -136.08 13.17 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.23 0.468 . . . . 0.0 111.609 178.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.93 55.93 7.21 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.427 HG22 HG13 ' A' ' 119' ' ' ILE . 22.4 m -136.32 179.89 3.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 C-N-CA 123.114 0.565 . . . . 0.0 110.313 175.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -82.63 159.76 22.61 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 176.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 25.5 m -57.53 -40.22 78.32 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 122.007 -0.433 . . . . 0.0 110.89 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -72.51 -20.81 61.29 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.655 0.382 . . . . 0.0 111.849 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -72.53 -36.7 68.36 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.635 -0.666 . . . . 0.0 109.97 176.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.24 -38.45 82.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.22 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.19 -32.86 73.55 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 117.56 0.164 . . . . 0.0 110.726 178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 84.4 m -78.45 -39.37 38.79 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 122.43 -0.169 . . . . 0.0 110.751 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.2 mp -65.34 -32.38 74.0 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 119.333 -0.365 . . . . 0.0 111.6 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 33.3 m -82.8 -29.17 8.39 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.097 0 CA-C-N 118.586 0.63 . . . . 0.0 110.912 178.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 50.9 m -67.42 -38.36 84.47 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -78.5 -27.17 46.08 Favored 'General case' 0 N--CA 1.454 -0.23 0 O-C-N 122.347 -0.221 . . . . 0.0 110.658 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.88 -45.37 67.83 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 117.833 0.288 . . . . 0.0 110.769 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.52 -22.37 57.16 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.193 -0.317 . . . . 0.0 111.232 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -72.66 -38.11 67.74 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.71 -26.24 61.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 O-C-N 122.351 -0.218 . . . . 0.0 110.489 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 15.3 mm -74.2 -51.18 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -66.14 -23.06 66.41 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -174.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -84.13 -10.74 57.54 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.478 ' C ' ' H ' ' A' ' 142' ' ' ARG . 16.5 pt20 -153.67 -54.44 0.11 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.478 1.659 . . . . 0.0 115.478 -177.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 18.9 p 46.86 -3.91 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.872 1.669 . . . . 0.0 114.982 -166.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.478 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.0 OUTLIER -78.01 166.13 23.2 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.306 0.957 . . . . 0.0 110.305 179.503 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -68.37 165.31 18.98 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.04 177.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -77.17 23.79 0.18 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.545 0.738 . . . . 0.0 110.709 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -135.37 21.26 3.4 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.881 0.873 . . . . 0.0 109.495 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.477 HD23 ' H ' ' A' ' 147' ' ' VAL . 0.6 OUTLIER -142.74 170.18 16.19 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.623 0.769 . . . . 0.0 109.817 -179.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.477 ' H ' HD23 ' A' ' 146' ' ' LEU . 4.1 t 44.55 52.23 9.53 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 124.24 1.016 . . . . 0.0 111.57 -176.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.32 -0.67 10.34 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 123.582 2.855 . . . . 0.0 112.382 -176.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -150.76 160.18 44.03 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 122.974 0.51 . . . . 0.0 109.99 -177.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -156.3 14.46 0.38 Allowed Glycine 0 CA--C 1.527 0.837 0 N-CA-C 111.536 -0.626 . . . . 0.0 111.536 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 37.8 m -65.98 177.73 1.28 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.039 0.935 . . . . 0.0 111.465 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -134.13 19.0 3.74 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.449 0.7 . . . . 0.0 110.631 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 58.8 m80 54.64 17.44 1.68 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.471 1.108 . . . . 0.0 112.794 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 51.6 p-80 -67.84 -4.52 12.95 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.522 0.729 . . . . 0.0 111.559 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -70.99 -2.36 15.08 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.887 0.875 . . . . 0.0 111.85 177.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -149.01 162.23 40.33 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.484 0.714 . . . . 0.0 109.635 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 67.9 m80 . . . . . 0 C--O 1.251 1.181 0 CA-C-O 117.313 -1.327 . . . . 0.0 110.511 -177.586 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 20.5 tp -146.89 9.08 0.99 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 122.397 0.279 . . . . 0.0 110.902 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -140.32 6.06 2.1 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.794 -0.566 . . . . 0.0 112.085 -176.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 73.9 mt -144.59 152.31 52.62 Favored Pre-proline 0 CA--C 1.53 0.211 0 C-N-CA 123.739 0.816 . . . . 0.0 109.687 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -75.68 -0.3 10.02 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.228 3.285 . . . . 0.0 113.335 -177.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.62 24.35 76.31 Favored Glycine 0 CA--C 1.53 1.013 0 O-C-N 121.603 -0.686 . . . . 0.0 112.118 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -138.37 8.48 2.66 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.064 0.546 . . . . 0.0 110.995 -178.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -143.79 12.97 1.69 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.316 1.047 . . . . 0.0 110.421 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -65.78 -14.69 61.86 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.226 1.01 . . . . 0.0 113.329 -177.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 75.7 tttt 49.79 36.89 12.02 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.203 1.001 . . . . 0.0 112.777 -176.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -132.45 27.35 4.41 Favored 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 124.32 1.048 . . . . 0.0 109.512 177.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -140.23 -174.96 4.08 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.093 0.957 . . . . 0.0 110.109 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 11.0 t -134.25 16.47 3.76 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.723 0.409 . . . . 0.0 110.909 -176.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 24.8 t -148.64 167.76 24.62 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.316 0.646 . . . . 0.0 109.598 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.57 171.56 19.24 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 123.058 0.543 . . . . 0.0 110.778 -177.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 38.2 mtmm -141.33 168.4 19.88 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 123.758 0.823 . . . . 0.0 109.829 178.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 49.8 m -148.86 161.04 34.05 Favored Pre-proline 0 CA--C 1.53 0.211 0 C-N-CA 122.935 0.494 . . . . 0.0 110.489 -178.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.27 174.38 0.24 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 124.698 3.599 . . . . 0.0 113.649 175.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.72 174.19 1.1 Allowed 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.851 0.86 . . . . 0.0 111.663 176.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' B' ' 20' ' ' LYS . 14.8 tptm -150.29 157.83 43.5 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.684 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 27.8 m -146.96 -172.89 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 C-N-CA 123.879 0.871 . . . . 0.0 109.864 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.92 4.62 4.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.363 0.665 . . . . 0.0 111.562 -178.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 31.4 t -155.51 168.17 28.0 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.359 0.664 . . . . 0.0 109.396 178.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -143.94 167.13 23.06 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 123.502 0.721 . . . . 0.0 109.986 -177.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -67.97 -18.78 64.84 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.122 0.569 . . . . 0.0 112.0 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 51.5 tpt85 58.54 -41.72 0.06 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 127.891 2.477 . . . . 0.0 114.661 -176.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -164.12 -9.95 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.826 0.85 . . . . 0.0 111.479 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.3 tpt -62.26 -26.8 68.59 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 118.034 0.379 . . . . 0.0 111.656 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.57 -36.18 58.89 Favored Glycine 0 C--N 1.338 0.643 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.79 -24.47 58.66 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.968 0.384 . . . . 0.0 110.813 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.86 -45.48 70.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 84.2 mt -76.49 -36.46 57.82 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.598 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -65.5 -42.46 92.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 39.1 t -64.01 -42.05 97.26 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.355 0.525 . . . . 0.0 111.028 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.13 -29.39 70.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.561 0.219 . . . . 0.0 111.463 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -102.86 -12.49 17.51 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 122.125 -0.359 . . . . 0.0 111.331 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . 0.491 HE21 ' CG ' ' B' ' 41' ' ' GLU . 62.9 tp60 -69.16 -34.11 74.46 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 175.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -73.89 -24.71 59.75 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 121.068 -0.253 . . . . 0.0 110.937 176.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 26.6 m -73.14 -12.14 60.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 27.2 pt -123.25 18.02 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.097 0 O-C-N 121.814 -0.554 . . . . 0.0 112.464 -175.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . 0.491 ' CG ' HE21 ' B' ' 37' ' ' GLN . 74.0 mm-40 -132.85 25.29 4.32 Favored 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -177.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -141.42 -15.77 0.84 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -166.41 158.8 14.05 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.179 0.9 . . . . 0.0 111.451 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.84 150.49 59.89 Favored Pre-proline 0 C--O 1.233 0.185 0 C-N-CA 124.318 1.047 . . . . 0.0 108.536 171.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . 0.404 ' C ' ' H ' ' B' ' 47' ' ' GLU . 72.1 Cg_endo -73.83 -35.78 4.14 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 123.016 2.478 . . . . 0.0 112.588 -177.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 35.2 t70 49.28 -10.49 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 127.481 2.312 . . . . 0.0 116.231 -177.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' B' ' 45' ' ' PRO . 15.7 pt-20 -69.4 -16.97 63.61 Favored 'General case' 0 CA--C 1.529 0.15 0 O-C-N 120.921 -1.112 . . . . 0.0 111.831 -177.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 42.0 mtm -74.09 -12.22 60.54 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.95 0.5 . . . . 0.0 111.297 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' B' ' 49' ' ' LEU . 87.9 mt -108.37 -17.28 14.04 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 176.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -68.19 -21.08 64.89 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 170.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.425 ' O ' ' HE2' ' B' ' 54' ' ' LYS . 4.2 pp -98.68 -6.82 28.92 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 122.881 0.472 . . . . 0.0 112.174 177.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.442 ' C ' ' H ' ' B' ' 54' ' ' LYS . 20.9 mt -89.9 -15.19 32.66 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.918 0.781 . . . . 0.0 109.906 166.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.59 22.68 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.532 1.133 . . . . 0.0 111.296 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.442 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.5 pttt -135.16 -4.11 2.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.78 0.832 . . . . 0.0 112.087 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -155.96 -5.83 0.12 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.39 2.46 0.64 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.958 0.799 . . . . 0.0 112.853 -176.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 4.2 mt -152.3 159.56 43.47 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.928 0.491 . . . . 0.0 110.58 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -148.86 162.56 39.6 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.242 1.017 . . . . 0.0 108.823 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 26.8 tp -151.88 -6.76 0.23 Allowed 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 13.0 p -153.61 138.44 11.38 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 118.736 0.698 . . . . 0.0 109.833 -178.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -73.65 175.02 11.28 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.434 2.756 . . . . 0.0 110.997 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.208 0 C-N-CA 123.092 0.557 . . . . 0.0 111.033 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptm . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.2 m -142.35 21.77 2.04 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.054 0.542 . . . . 0.0 111.524 -174.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 68.1 tp -52.63 -30.81 33.51 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.485 0.714 . . . . 0.0 112.597 -177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.97 -20.79 78.06 Favored Glycine 0 C--N 1.338 0.665 0 C-N-CA 121.254 -0.498 . . . . 0.0 112.427 -176.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -79.07 -1.0 33.68 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 117.42 0.61 . . . . 0.0 111.684 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -134.1 -13.88 2.4 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 122.452 0.301 . . . . 0.0 111.594 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 tp -80.23 -42.08 23.91 Favored 'General case' 0 N--CA 1.454 -0.255 0 O-C-N 122.197 -0.314 . . . . 0.0 110.166 173.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.453 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -55.37 -45.47 99.86 Favored Pre-proline 0 CA--C 1.531 0.219 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -175.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.453 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 74.3 Cg_endo -70.64 -4.16 14.05 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.373 2.048 . . . . 0.0 112.177 -178.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -131.31 10.17 4.84 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.413 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 48.3 mt -57.26 -40.34 84.0 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.351 -0.833 . . . . 0.0 112.434 173.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 88.1 Cg_endo -77.87 -16.47 14.44 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 CA-C-N 120.842 1.337 . . . . 0.0 112.634 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -69.66 -24.98 63.69 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 118.435 0.561 . . . . 0.0 109.867 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.71 -21.65 65.3 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 175.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -92.46 -22.19 19.74 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.488 0.315 . . . . 0.0 110.386 178.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.3 ttp180 -52.69 -29.02 24.34 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 124.271 1.028 . . . . 0.0 110.773 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -138.27 -9.69 1.49 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 111.433 0.16 . . . . 0.0 111.433 177.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.97 -37.19 91.96 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.89 -29.98 66.21 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.99 0.895 . . . . 0.0 110.264 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.23 -2.01 32.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.431 0.692 . . . . 0.0 111.358 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.3 mt -114.9 5.13 15.02 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.629 0.772 . . . . 0.0 111.501 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.8 p -141.6 -22.63 0.73 Allowed 'General case' 0 C--O 1.231 0.109 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.86 17.29 50.14 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.287 0.494 . . . . 0.0 112.08 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 41.2 t -153.45 131.97 12.16 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 117.62 0.71 . . . . 0.0 110.023 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.94 -20.77 64.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.872 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -70.94 -38.5 72.86 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.065 0.393 . . . . 0.0 110.578 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -82.19 -28.25 32.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 122.21 0.204 . . . . 0.0 110.745 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.6 -39.03 26.56 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.781 -0.927 . . . . 0.0 110.781 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -73.31 -30.37 63.33 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 117.283 0.542 . . . . 0.0 111.088 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.1 -25.22 27.68 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 120.178 -0.609 . . . . 0.0 111.413 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -63.57 -37.91 89.13 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.076 0.853 . . . . 0.0 109.442 171.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.3 t -63.79 -46.65 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 117.704 0.229 . . . . 0.0 110.772 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -79.21 -32.59 44.05 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.534 -175.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.53 -25.99 63.37 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.0 m -64.13 -43.76 94.28 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.88 -41.28 62.42 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.573 -178.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -62.46 -26.75 68.69 Favored 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.121 -0.362 . . . . 0.0 111.823 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.59 0.63 29.23 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.898 0.479 . . . . 0.0 111.363 178.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 72.6 mt -120.66 -13.47 8.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 C-N-CA 124.227 1.011 . . . . 0.0 109.866 -177.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.6 t -58.83 -11.48 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 123.62 0.768 . . . . 0.0 111.921 175.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.75 3.0 9.52 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 123.47 0.708 . . . . 0.0 110.579 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.12 53.66 0.96 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 123.888 0.875 . . . . 0.0 110.978 -174.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.23 -10.12 27.97 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.933 2.422 . . . . 0.0 113.264 -175.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -78.96 -17.84 54.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.415 0.552 . . . . 0.0 110.654 176.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -78.56 -1.19 32.81 Favored 'General case' 0 C--N 1.335 -0.062 0 C-N-CA 125.025 1.33 . . . . 0.0 111.464 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -131.26 60.51 53.3 Favored Pre-proline 0 CA--C 1.532 0.266 0 C-N-CA 123.559 0.744 . . . . 0.0 109.995 -176.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -71.25 171.52 15.88 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 124.057 3.172 . . . . 0.0 111.409 -176.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -115.51 12.84 16.29 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.167 0.987 . . . . 0.0 109.658 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -72.27 10.09 0.86 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.71 1.204 . . . . 0.0 111.507 176.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.0 m -134.95 174.87 12.25 Favored 'Isoleucine or valine' 0 C--O 1.231 0.086 0 C-N-CA 124.386 1.074 . . . . 0.0 109.504 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -55.4 148.05 34.78 Favored Pre-proline 0 CA--C 1.53 0.184 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -68.34 10.62 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 123.865 3.043 . . . . 0.0 112.139 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -129.08 -25.06 2.8 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.012 0.525 . . . . 0.0 111.18 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.82 -32.98 68.13 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 118.522 0.601 . . . . 0.0 110.189 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.38 -34.14 57.91 Favored Glycine 0 C--N 1.338 0.645 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 177.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.39 -43.65 96.98 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.961 0.381 . . . . 0.0 109.992 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.3 m-30 -79.14 -32.23 44.32 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -62.46 -41.12 98.53 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 122.179 -0.326 . . . . 0.0 110.959 -178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -80.93 -29.94 35.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.665 -177.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -66.86 -35.89 81.08 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 175.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -67.38 -27.68 67.3 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.114 0.566 . . . . 0.0 109.807 176.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.07 -39.86 92.96 Favored Glycine 0 CA--C 1.528 0.871 0 CA-C-O 119.796 -0.447 . . . . 0.0 112.055 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 48.6 mm -72.9 -37.97 55.55 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.071 0 CA-C-N 118.132 0.966 . . . . 0.0 110.264 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -31.79 70.1 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.9 -31.4 61.56 Favored 'General case' 0 N--CA 1.456 -0.133 0 O-C-N 121.309 -0.869 . . . . 0.0 110.503 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 33.8 t -75.52 -28.04 58.96 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.587 0.355 . . . . 0.0 110.988 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.44 -40.92 70.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 122.158 -0.339 . . . . 0.0 110.124 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -72.57 -16.03 61.75 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 122.382 -0.199 . . . . 0.0 110.954 175.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.27 4.36 39.28 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.888 0.475 . . . . 0.0 110.968 177.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -133.29 -4.33 3.03 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.41 0.684 . . . . 0.0 111.128 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 97.39 -4.98 62.45 Favored Glycine 0 CA--C 1.525 0.696 0 CA-C-O 119.591 -0.561 . . . . 0.0 113.186 175.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -67.17 135.07 52.94 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 117.891 0.845 . . . . 0.0 110.31 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -165.69 173.57 10.63 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.451 0.701 . . . . 0.0 110.58 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -147.37 168.52 21.61 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 124.231 1.012 . . . . 0.0 109.085 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.4 t -64.9 -21.37 66.8 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.795 0.438 . . . . 0.0 111.363 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 92.1 p 44.72 24.16 0.1 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.767 1.627 . . . . 0.0 114.226 178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -56.01 -60.41 3.52 Favored 'General case' 0 CA--C 1.527 0.065 0 C-N-CA 123.139 0.576 . . . . 0.0 111.572 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 81.0 p -178.79 177.53 0.86 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 123.558 0.743 . . . . 0.0 110.635 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -138.18 17.74 2.79 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.365 1.066 . . . . 0.0 108.797 175.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.62 -173.59 4.57 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.188 0.995 . . . . 0.0 110.219 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -139.81 10.8 2.44 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.787 0.435 . . . . 0.0 112.014 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -167.62 9.28 0.05 OUTLIER Glycine 0 CA--C 1.529 0.958 0 CA-C-O 119.359 -0.689 . . . . 0.0 113.721 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.5 t -147.4 7.52 0.88 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.471 1.135 . . . . 0.0 111.946 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -152.43 -33.07 0.13 Allowed 'General case' 0 CA--C 1.528 0.117 0 O-C-N 121.935 -0.478 . . . . 0.0 109.79 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.12 -23.71 63.07 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.9 p -66.84 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.339 0.138 0 C-N-CA 122.664 0.386 . . . . 0.0 110.03 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.7 -17.12 52.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 122.732 0.413 . . . . 0.0 111.137 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -88.1 -51.34 5.85 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.26 -1.67 4.86 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -171.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -130.22 6.22 4.91 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 123.015 0.526 . . . . 0.0 111.996 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 84.9 mt -144.5 19.27 1.7 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.791 0.836 . . . . 0.0 110.782 -178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.51 5.95 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -174.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -130.39 0.97 4.57 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 119.337 0.971 . . . . 0.0 112.255 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.3 ttm -68.17 152.15 45.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.2 m -59.25 137.88 88.5 Favored Pre-proline 0 CA--C 1.532 0.251 0 C-N-CA 123.178 0.591 . . . . 0.0 109.667 176.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.36 5.42 1.55 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 123.933 3.089 . . . . 0.0 114.01 -176.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -130.95 -32.68 1.62 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 118.632 0.651 . . . . 0.0 110.298 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 19.6 m -62.64 -19.38 63.74 Favored 'General case' 0 CA--C 1.527 0.069 0 O-C-N 121.852 -0.53 . . . . 0.0 110.39 173.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.83 -33.84 76.78 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.071 0.548 . . . . 0.0 110.517 175.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -77.59 -30.37 52.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.53 -32.35 73.07 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 122.07 -0.394 . . . . 0.0 110.289 175.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 38.2 tp -66.32 -44.13 84.25 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 122.763 0.425 . . . . 0.0 110.438 178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.87 -10.01 59.08 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.456 0.571 . . . . 0.0 111.677 -179.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.8 mt -96.58 -4.71 40.73 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 67.7 p -137.19 6.05 2.8 Favored 'General case' 0 N--CA 1.461 0.124 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -177.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -139.54 10.55 2.49 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 177.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.5 mtm -140.07 -10.11 1.14 Allowed 'General case' 0 C--N 1.341 0.216 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -148.1 -8.25 0.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.225 0.92 . . . . 0.0 112.634 178.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 70.22 20.0 76.26 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.296 -0.724 . . . . 0.0 113.848 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -58.0 150.6 20.38 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.64 1.22 . . . . 0.0 109.884 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 93.2 p -70.24 160.79 79.61 Favored Pre-proline 0 C--O 1.233 0.207 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.82 -16.07 45.25 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 121.933 1.755 . . . . 0.0 110.521 176.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -79.28 -37.43 37.85 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 117.94 0.336 . . . . 0.0 110.823 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -76.95 -36.09 56.79 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 117.938 0.335 . . . . 0.0 110.129 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -70.0 -27.53 64.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 119.591 -0.243 . . . . 0.0 111.227 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -73.97 -36.44 64.58 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.727 0.298 . . . . 0.0 110.575 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -68.52 -31.11 70.13 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 122.861 0.465 . . . . 0.0 110.688 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.86 -7.45 57.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.899 0.704 . . . . 0.0 112.899 -177.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 8.6 pt -135.72 13.92 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 118.739 0.699 . . . . 0.0 111.992 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 56.8 53.61 8.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 176.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 29.1 m -137.16 179.13 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 122.936 0.494 . . . . 0.0 110.399 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.31 161.32 20.48 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 122.758 0.423 . . . . 0.0 110.178 176.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 24.7 m -60.74 -36.55 79.19 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 122.057 -0.402 . . . . 0.0 110.919 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -23.95 61.48 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.371 0.268 . . . . 0.0 110.946 -178.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.39 -36.55 68.7 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.789 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.7 t -64.81 -36.5 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.1 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -62.87 -34.57 77.66 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 120.651 0.263 . . . . 0.0 110.594 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.1 m -77.03 -37.52 54.74 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 177.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 5.9 mp -66.46 -32.79 74.38 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 119.074 -0.489 . . . . 0.0 111.694 -178.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.62 -26.59 12.52 Favored 'Isoleucine or valine' 0 C--N 1.338 0.094 0 CA-C-N 118.873 0.761 . . . . 0.0 110.811 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 99.0 m -68.89 -37.72 79.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 176.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -76.34 -27.62 56.56 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 122.273 -0.267 . . . . 0.0 110.319 176.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.4 -48.07 62.22 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 117.852 0.296 . . . . 0.0 110.471 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.87 -22.74 65.1 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 117.855 0.298 . . . . 0.0 111.129 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -75.44 -38.62 59.62 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 173.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -69.46 -30.11 67.94 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 119.757 -0.163 . . . . 0.0 110.571 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.9 mm -64.71 -49.41 80.35 Favored 'Isoleucine or valine' 0 C--N 1.339 0.12 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -67.69 -20.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -77.76 -20.88 52.61 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -176.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -151.69 -10.63 0.21 Allowed 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 36.4 p -68.96 -19.03 64.16 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 119.951 1.25 . . . . 0.0 112.164 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.31 157.46 31.62 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 122.718 0.407 . . . . 0.0 111.093 177.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -150.26 4.88 0.54 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 5.3 mp -142.0 163.62 32.39 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.017 0.527 . . . . 0.0 109.85 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -142.45 1.7 1.39 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.599 0.759 . . . . 0.0 110.572 177.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.564 ' CD1' ' H ' ' A' ' 147' ' ' VAL . 0.1 OUTLIER -155.54 178.25 10.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.248 1.019 . . . . 0.0 108.477 -179.227 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.564 ' H ' ' CD1' ' A' ' 146' ' ' LEU . 52.5 t -141.2 125.3 10.31 Favored Pre-proline 0 N--CA 1.455 -0.218 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -75.69 172.83 15.56 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.699 2.933 . . . . 0.0 111.501 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -143.77 166.93 23.51 Favored 'General case' 0 C--O 1.23 0.073 0 C-N-CA 123.557 0.743 . . . . 0.0 110.014 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 176.89 -179.14 47.99 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 84.9 p -153.88 172.8 16.82 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 122.613 0.365 . . . . 0.0 110.751 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 69.3 m80 -146.33 172.62 13.21 Favored 'General case' 0 N--CA 1.456 -0.127 0 C-N-CA 123.738 0.815 . . . . 0.0 109.948 -178.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -146.48 9.56 1.07 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.577 0.351 . . . . 0.0 111.912 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 19.3 p80 -153.69 169.45 23.26 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 122.867 0.467 . . . . 0.0 110.641 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 52.9 p-80 -153.7 -1.52 0.21 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.077 0.551 . . . . 0.0 111.603 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 38.1 t-80 -157.45 166.15 33.76 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.114 0.566 . . . . 0.0 109.879 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 76.6 t60 . . . . . 0 C--O 1.252 1.226 0 CA-C-O 117.177 -1.392 . . . . 0.0 110.393 179.685 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 110.475 -0.194 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . 0.4 HD23 ' H ' ' B' ' 2' ' ' LEU . 1.7 pt? -148.81 5.03 0.67 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.964 0.505 . . . . 0.0 111.975 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -153.78 163.59 39.76 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 89.9 mt -144.81 160.67 46.26 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 123.853 0.861 . . . . 0.0 109.802 -177.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -52.01 162.36 1.94 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 124.148 3.232 . . . . 0.0 113.09 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -174.77 2.14 0.03 OUTLIER Glycine 0 CA--C 1.528 0.893 0 CA-C-O 119.719 -0.49 . . . . 0.0 112.758 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -152.54 150.93 30.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 117.921 0.861 . . . . 0.0 109.547 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -144.25 8.79 1.41 Allowed 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.441 0.697 . . . . 0.0 111.361 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -75.16 -5.84 46.47 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.735 0.414 . . . . 0.0 110.852 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -67.23 -3.36 7.62 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.627 0.771 . . . . 0.0 112.105 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -143.9 2.46 1.19 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.189 0.595 . . . . 0.0 112.026 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . 48.67 -169.2 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.048 0.939 . . . . 0.0 112.855 -175.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 49.7 m -139.29 5.88 2.3 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.028 0.531 . . . . 0.0 111.383 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 25.0 m 50.49 16.83 0.31 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.03 1.332 . . . . 0.0 114.141 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -142.55 0.9 1.32 Allowed 'General case' 0 C--N 1.34 0.183 0 C-N-CA 123.215 0.606 . . . . 0.0 111.646 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -157.7 156.52 31.85 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.246 0.618 . . . . 0.0 109.435 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 83.1 p -153.7 156.8 32.5 Favored Pre-proline 0 CA--C 1.53 0.182 0 C-N-CA 122.873 0.469 . . . . 0.0 109.86 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -78.09 4.94 5.75 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 124.239 3.293 . . . . 0.0 112.269 178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.31 148.44 32.18 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.785 0.434 . . . . 0.0 111.969 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -162.65 157.07 21.39 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 174.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 19.9 m -144.8 161.99 13.89 Favored 'Isoleucine or valine' 0 C--O 1.23 0.078 0 C-N-CA 123.111 0.565 . . . . 0.0 110.411 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -157.22 18.7 0.29 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.667 0.787 . . . . 0.0 110.929 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.0 p -51.25 148.28 4.86 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.439 0.696 . . . . 0.0 112.592 -175.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 ptpp? -156.1 14.84 0.33 Allowed 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 124.307 1.043 . . . . 0.0 110.515 -178.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -75.18 18.2 0.21 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 125.024 1.33 . . . . 0.0 112.419 -177.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.3 ptp180 -143.79 171.38 14.29 Favored 'General case' 0 N--CA 1.458 -0.059 0 C-N-CA 123.103 0.561 . . . . 0.0 111.826 -172.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -142.27 22.26 2.04 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 123.925 0.89 . . . . 0.0 111.067 -175.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.2 tpt -52.93 -26.97 16.71 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.634 0.773 . . . . 0.0 112.349 -177.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.22 -40.54 87.7 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.165 -0.774 . . . . 0.0 111.165 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.24 -22.7 60.36 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.549 -0.383 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.88 -37.83 67.18 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 81.7 mt -73.97 -37.41 64.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.98 -32.45 72.86 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 119.533 -0.27 . . . . 0.0 110.479 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 62.3 m -66.62 -43.86 83.62 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.221 0.464 . . . . 0.0 110.705 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -26.97 65.12 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 15.9 m-30 -103.7 -16.54 15.43 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 122.111 -0.368 . . . . 0.0 111.526 -176.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 63.7 tp60 -64.45 -33.67 76.41 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 169.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -55.15 -38.66 68.54 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.157 0.583 . . . . 0.0 110.646 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 95.6 m -67.06 -12.61 60.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.835 0.454 . . . . 0.0 112.208 176.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 69.6 mt -105.54 -14.89 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.048 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -75.54 19.51 0.19 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.855 0.462 . . . . 0.0 111.53 176.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -136.48 169.05 18.31 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.054 0.454 . . . . 0.0 111.055 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -56.37 165.31 1.11 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.761 1.224 . . . . 0.0 113.129 -173.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.5 m -125.92 155.61 72.79 Favored Pre-proline 0 C--O 1.232 0.169 0 C-N-CA 124.022 0.929 . . . . 0.0 109.663 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.9 179.62 6.32 Favored 'Trans proline' 0 N--CA 1.448 -1.152 0 C-N-CA 122.938 2.425 . . . . 0.0 109.898 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -146.77 0.25 0.75 Allowed 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.589 0.356 . . . . 0.0 111.071 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -67.81 -18.13 64.74 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -175.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.9 mpp? -70.22 -29.15 65.9 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-N 118.204 0.456 . . . . 0.0 109.8 176.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.45 ' N ' HD22 ' B' ' 49' ' ' LEU . 2.4 mm? -93.31 -25.02 17.92 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.49 -20.88 66.53 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 174.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.4 pp -98.11 0.61 46.39 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.492 0.317 . . . . 0.0 111.626 175.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' B' ' 52' ' ' LEU . 23.8 mt -83.84 -21.83 31.92 Favored 'General case' 0 CA--C 1.528 0.115 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 166.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -66.12 17.28 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.1 0.96 . . . . 0.0 113.155 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' B' ' 52' ' ' LEU . 60.4 pttt -128.12 6.18 5.92 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.427 0.691 . . . . 0.0 111.236 177.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.2 -15.51 0.35 Allowed 'General case' 0 C--N 1.34 0.178 0 C-N-CA 123.107 0.563 . . . . 0.0 111.591 174.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.83 -2.46 23.73 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 117.935 0.334 . . . . 0.0 110.697 171.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 28.5 tp -151.81 169.85 21.22 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.54 1.136 . . . . 0.0 108.714 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 57.83 -176.26 0.07 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.411 1.084 . . . . 0.0 112.287 -176.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -120.8 9.07 10.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.497 0.719 . . . . 0.0 110.754 -177.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 14.0 p -150.86 138.96 12.55 Favored Pre-proline 0 CA--C 1.532 0.26 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -73.38 174.28 12.4 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.544 2.829 . . . . 0.0 111.287 178.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 51.3 tpt85 . . . . . 0 N--CA 1.458 -0.073 0 C-N-CA 123.416 0.687 . . . . 0.0 110.39 -179.597 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.5 tpp . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 119.819 -0.134 . . . . 0.0 110.803 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.3 t -152.18 153.38 33.72 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 122.712 0.405 . . . . 0.0 110.127 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 50.2 tp -67.52 -26.68 66.45 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.335 0.654 . . . . 0.0 111.228 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.95 -23.14 78.41 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.744 -0.598 . . . . 0.0 112.046 -176.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -81.17 2.99 25.19 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 122.865 0.466 . . . . 0.0 111.004 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -131.51 -21.71 2.51 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.532 0.733 . . . . 0.0 111.089 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.3 tp -78.55 -38.79 39.54 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 122.298 -0.251 . . . . 0.0 110.926 176.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.413 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.8 -45.78 99.78 Favored Pre-proline 0 CA--C 1.536 0.419 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -172.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 77.4 Cg_endo -72.86 -3.84 14.31 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.487 2.125 . . . . 0.0 113.285 -175.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -135.71 8.7 3.32 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.368 0.531 . . . . 0.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.8 tp -56.38 -44.03 99.55 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 124.14 0.976 . . . . 0.0 113.107 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.484 ' HG2' HD11 ' B' ' 40' ' ' ILE . 67.6 Cg_endo -81.8 -11.76 11.26 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.203 1.936 . . . . 0.0 113.373 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -64.9 -23.49 67.24 Favored 'General case' 0 C--N 1.338 0.097 0 CA-C-N 118.942 0.792 . . . . 0.0 111.255 -178.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.4 mt -66.75 -19.03 65.67 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 122.252 -0.28 . . . . 0.0 110.9 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.8 ttm105 -103.03 -20.91 14.02 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.702 0.401 . . . . 0.0 111.042 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -62.84 -16.43 58.44 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.364 0.529 . . . . 0.0 111.805 -177.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 15.6 p90 -140.32 -21.3 0.84 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.578 0.351 . . . . 0.0 111.449 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.66 -25.1 68.61 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 111.56 -0.616 . . . . 0.0 111.56 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -66.86 -12.12 58.11 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 117.386 0.593 . . . . 0.0 111.977 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -114.12 -6.45 13.07 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 122.962 0.505 . . . . 0.0 111.881 -174.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.5 mt -82.76 -0.36 47.34 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.04 0.382 . . . . 0.0 111.22 174.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 t -148.29 -4.13 0.47 Allowed 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -175.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.16 17.04 78.54 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 121.553 -0.717 . . . . 0.0 113.034 174.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 36.3 t -156.1 126.23 6.56 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.143 0.971 . . . . 0.0 110.272 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -69.32 -19.04 63.88 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.715 -0.22 . . . . 0.0 110.78 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -74.29 -33.14 63.15 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 177.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -76.46 -35.11 58.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -71.36 -36.1 63.28 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -73.02 -34.67 66.5 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 117.565 0.682 . . . . 0.0 111.451 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.82 -22.93 49.24 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.431 178.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.4 m-30 -67.32 -36.79 82.19 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 37.3 t -60.4 -47.01 94.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.142 0 CA-C-N 117.932 0.333 . . . . 0.0 110.58 178.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -77.38 -29.86 53.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.511 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.67 -27.39 61.21 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.604 -0.147 . . . . 0.0 110.604 176.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 59.4 m -66.93 -38.9 87.03 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.43 -44.1 53.34 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 -176.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.3 -24.67 67.74 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 122.081 -0.387 . . . . 0.0 110.522 -178.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.38 0.16 23.48 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.378 0.671 . . . . 0.0 111.636 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 83.5 mt -122.7 -14.02 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 124.008 0.923 . . . . 0.0 109.879 -177.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 42.0 t -58.92 -15.54 6.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.142 0.577 . . . . 0.0 112.021 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.19 4.98 9.77 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.344 0.658 . . . . 0.0 110.884 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -155.18 53.88 0.91 Allowed Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.144 0.578 . . . . 0.0 111.199 -176.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -64.7 -10.83 26.26 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.291 2.66 . . . . 0.0 112.405 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.57 -15.34 61.29 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.494 0.318 . . . . 0.0 110.878 175.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -85.68 0.5 52.54 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 122.722 0.409 . . . . 0.0 111.664 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -129.17 63.99 69.3 Favored Pre-proline 0 CA--C 1.532 0.267 0 C-N-CA 122.799 0.44 . . . . 0.0 110.296 -176.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -69.24 168.36 21.1 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 124.214 3.276 . . . . 0.0 111.918 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -121.53 12.17 10.73 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.054 0.942 . . . . 0.0 109.795 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -72.68 10.68 0.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.196 0.998 . . . . 0.0 111.52 176.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.4 m -135.86 174.69 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.098 0 C-N-CA 124.2 1.0 . . . . 0.0 109.216 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.31 146.23 32.92 Favored Pre-proline 0 CA--C 1.531 0.223 0 C-N-CA 122.104 0.161 . . . . 0.0 110.824 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.07 11.78 0.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 124.242 3.294 . . . . 0.0 112.37 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -128.75 -16.6 4.18 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.028 0.531 . . . . 0.0 110.428 174.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -79.63 -35.87 38.75 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 118.136 0.426 . . . . 0.0 109.888 -178.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -77.61 -32.63 45.68 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.475 -1.05 . . . . 0.0 110.475 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.2 -46.6 89.17 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.059 0.543 . . . . 0.0 110.214 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.1 m-30 -74.05 -33.85 63.85 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.721 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.6 tpm_? -63.77 -43.15 97.23 Favored 'General case' 0 C--N 1.337 0.05 0 CA-C-N 118.728 0.695 . . . . 0.0 111.116 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 88.8 mmm -71.0 -34.38 71.32 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.479 -0.489 . . . . 0.0 110.576 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -68.82 -37.07 78.94 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 122.325 -0.234 . . . . 0.0 110.748 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -67.94 -20.17 65.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.509 0.323 . . . . 0.0 110.377 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -73.1 -40.41 50.81 Favored Glycine 0 C--N 1.338 0.671 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 47.4 mm -73.61 -34.34 41.47 Favored 'Isoleucine or valine' 0 C--N 1.338 0.089 0 CA-C-N 117.552 0.676 . . . . 0.0 109.852 176.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.0 t90 -65.54 -36.36 83.57 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.419 179.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.06 69.53 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.082 -0.386 . . . . 0.0 110.563 177.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 31.1 t -75.07 -28.93 60.53 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.317 0.247 . . . . 0.0 110.743 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.02 64.77 Favored 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 122.334 -0.229 . . . . 0.0 111.049 178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -86.64 -12.84 47.32 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.465 0.306 . . . . 0.0 110.758 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.4 4.56 34.84 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.191 0.596 . . . . 0.0 111.131 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -137.7 0.82 2.27 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.107 0.563 . . . . 0.0 111.033 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.34 13.13 83.12 Favored Glycine 0 CA--C 1.528 0.885 0 CA-C-O 119.676 -0.514 . . . . 0.0 113.12 176.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -64.25 -18.38 64.5 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 117.949 0.875 . . . . 0.0 110.901 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -156.42 155.15 31.61 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.119 0.968 . . . . 0.0 109.095 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -146.89 -10.68 0.45 Allowed 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.8 t -164.52 174.52 10.82 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.767 -177.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 89.7 p -155.82 167.3 30.84 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.736 0.814 . . . . 0.0 110.087 177.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -152.29 -50.34 0.11 Allowed 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 122.452 -0.155 . . . . 0.0 111.279 177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.1 t -169.31 160.49 9.49 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 122.506 0.322 . . . . 0.0 110.985 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -160.24 23.73 0.16 Allowed 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.082 0.953 . . . . 0.0 110.037 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.39 174.75 10.47 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-O 121.163 0.506 . . . . 0.0 111.227 -176.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -9.38 17.32 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 160.86 -11.79 0.14 Allowed Glycine 0 CA--C 1.527 0.828 0 CA-C-O 119.566 -0.575 . . . . 0.0 113.121 178.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.5 p -66.65 -3.54 6.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 118.295 1.047 . . . . 0.0 113.066 -176.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -129.19 -29.76 2.23 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.47 -28.92 68.27 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 175.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.9 p -65.89 -29.86 48.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 120.869 0.366 . . . . 0.0 110.444 178.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.12 -0.06 53.28 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.395 0.678 . . . . 0.0 111.809 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -130.48 -16.59 3.43 Favored 'General case' 0 C--N 1.339 0.151 0 CA-C-N 117.865 0.302 . . . . 0.0 111.229 176.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.45 -1.42 15.67 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 122.855 0.462 . . . . 0.0 110.447 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -130.49 -12.87 3.88 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.352 178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 73.8 mt -144.82 34.21 1.13 Allowed 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.338 0.655 . . . . 0.0 111.247 -171.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.7 2.88 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -130.52 -5.92 4.18 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.532 1.06 . . . . 0.0 112.3 -177.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 58.8 ttm -67.35 146.05 54.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.325 0.511 . . . . 0.0 110.31 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 93.9 m -65.65 137.25 96.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.83 -20.75 39.05 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.578 2.185 . . . . 0.0 112.956 -174.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -78.61 -34.73 46.43 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 177.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.3 m -65.36 -23.41 66.98 Favored 'General case' 0 N--CA 1.457 -0.105 0 O-C-N 122.043 -0.411 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 62.6 mtm180 -67.88 -26.0 65.79 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.063 0.392 . . . . 0.0 110.556 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -77.72 -39.0 45.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.57 -33.25 74.65 Favored 'General case' 0 N--CA 1.455 -0.197 0 O-C-N 122.082 -0.386 . . . . 0.0 110.202 177.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -54.43 46.89 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.974 0.509 . . . . 0.0 109.721 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.504 ' HA ' ' HE3' ' A' ' 107' ' ' MET . 4.4 pp -71.53 -15.44 62.3 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -174.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.1 mt -84.24 -9.3 58.63 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 117.882 0.31 . . . . 0.0 111.827 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.4 p -135.44 12.47 3.5 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -132.48 -0.65 3.57 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.504 ' HE3' ' HA ' ' A' ' 103' ' ' LEU . 33.3 mtm -145.9 -11.79 0.5 Allowed 'General case' 0 C--N 1.34 0.173 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -176.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -138.09 -2.91 1.82 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.23 0.923 . . . . 0.0 112.266 -175.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 55.58 26.47 45.81 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-O 119.167 -0.796 . . . . 0.0 114.315 173.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -56.68 151.62 13.63 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.493 1.146 . . . . 0.0 110.633 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 31.4 t -64.55 149.38 95.46 Favored Pre-proline 0 N--CA 1.453 -0.285 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 171.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -64.44 -16.54 55.67 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.938 1.759 . . . . 0.0 110.648 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -76.18 -39.85 53.81 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 117.767 0.258 . . . . 0.0 110.344 176.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -74.63 -35.26 62.9 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 122.119 -0.363 . . . . 0.0 110.312 177.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -68.04 -28.1 67.1 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 122.22 -0.3 . . . . 0.0 111.053 176.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -79.32 -27.69 42.1 Favored 'General case' 0 CA--C 1.526 0.05 0 C-N-CA 122.541 0.336 . . . . 0.0 110.403 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -75.13 -22.62 58.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.258 1.023 . . . . 0.0 111.037 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 69.8 mt -88.49 -7.88 55.8 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 7.5 pt -135.55 15.23 1.05 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 118.726 0.694 . . . . 0.0 111.351 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 46.13 62.17 2.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.952 1.701 . . . . 0.0 114.691 176.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 31.2 m -136.9 -179.78 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 C-N-CA 124.077 0.951 . . . . 0.0 109.392 174.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -81.41 159.93 24.19 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 27.6 m -60.6 -36.87 79.62 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 122.152 -0.342 . . . . 0.0 110.799 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.0 t -72.91 -24.64 60.86 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 122.134 0.174 . . . . 0.0 110.932 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -71.95 -34.14 68.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.085 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 94.9 t -65.72 -38.04 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.109 0 CA-C-N 118.211 0.46 . . . . 0.0 109.769 177.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.66 -35.78 77.07 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 87.7 m -76.29 -37.98 56.76 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.342 -0.224 . . . . 0.0 110.743 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 4.7 mp -65.17 -36.19 83.44 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.666 -178.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.44 -28.5 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.149 0 CA-C-N 118.515 0.598 . . . . 0.0 110.974 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 53.7 m -68.67 -38.79 80.65 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -78.17 -26.17 47.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 122.356 -0.215 . . . . 0.0 110.638 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.21 -50.74 37.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.57 -22.51 65.38 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 117.73 0.241 . . . . 0.0 111.1 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.29 -34.77 76.76 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -81.59 -18.62 44.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.279 -0.391 . . . . 0.0 111.261 176.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 25.9 mm -68.91 -53.13 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 173.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.65 -16.83 62.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -64.91 -21.44 66.82 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.437 ' C ' ' H ' ' A' ' 142' ' ' ARG . 19.2 pt20 -155.57 -43.32 0.08 Allowed 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -171.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 44.6 p 46.3 -1.97 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -169.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.437 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.1 OUTLIER -156.51 165.36 36.52 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 119.843 1.202 . . . . 0.0 110.413 174.36 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -147.08 23.51 1.19 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.076 0.551 . . . . 0.0 110.51 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.49 ' H ' HD23 ' A' ' 144' ' ' LEU . 1.5 pt? -138.59 176.84 8.35 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.616 0.766 . . . . 0.0 110.174 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 56.78 22.61 7.12 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.464 0.706 . . . . 0.0 110.767 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.56 -172.44 0.35 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.456 1.102 . . . . 0.0 111.504 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 28.9 m -128.26 153.63 78.87 Favored Pre-proline 0 CA--C 1.53 0.21 0 C-N-CA 123.549 0.74 . . . . 0.0 110.029 -177.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.24 176.01 9.16 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 124.434 3.422 . . . . 0.0 112.149 -178.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 45.43 -178.51 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 127.731 2.412 . . . . 0.0 115.208 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 175.02 23.8 0.03 OUTLIER Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.321 -0.711 . . . . 0.0 111.321 -177.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 70.0 p -59.35 164.66 3.16 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.486 0.715 . . . . 0.0 112.261 -177.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 28.9 p80 -148.84 16.23 0.97 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.718 0.807 . . . . 0.0 110.796 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 50.7 p-80 -143.95 -179.93 6.79 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.643 0.777 . . . . 0.0 110.4 -175.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -146.07 -179.5 6.76 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.079 0.552 . . . . 0.0 110.859 -177.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -146.43 168.29 21.52 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.234 0.614 . . . . 0.0 109.513 -179.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -146.16 14.67 1.31 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -175.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 35.7 m80 . . . . . 0 C--O 1.253 1.278 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.008 176.71 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 N--CA 1.477 0.908 0 N-CA-C 110.469 -0.197 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . 0.44 HD23 ' H ' ' B' ' 2' ' ' LEU . 1.7 pt? -144.89 4.29 1.11 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 122.596 0.358 . . . . 0.0 111.744 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -75.45 -2.81 30.51 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.862 0.465 . . . . 0.0 110.993 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.41 HD23 ' H ' ' B' ' 4' ' ' LEU . 1.8 pt? -151.91 156.65 34.3 Favored Pre-proline 0 N--CA 1.448 -0.543 0 C-N-CA 124.079 0.951 . . . . 0.0 109.049 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -73.96 -10.96 23.38 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.118 2.546 . . . . 0.0 112.64 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 124.99 -4.68 8.4 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-O 119.778 -0.456 . . . . 0.0 112.426 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -71.22 5.86 1.97 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 117.568 0.684 . . . . 0.0 112.827 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 77.0 tttt 51.45 28.78 4.72 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.996 0.918 . . . . 0.0 111.46 -177.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -149.99 173.25 14.03 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.533 0.733 . . . . 0.0 109.658 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -138.65 -173.68 3.62 Favored 'General case' 0 C--O 1.232 0.183 0 C-N-CA 124.09 0.956 . . . . 0.0 109.799 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 53.1 tttm 56.77 29.06 15.28 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.708 0.803 . . . . 0.0 111.073 -177.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.94 12.61 2.04 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.765 0.826 . . . . 0.0 110.66 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 32.2 t -153.0 173.82 14.93 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 123.876 0.87 . . . . 0.0 109.327 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 90.5 p -145.07 16.6 1.55 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.64 0.776 . . . . 0.0 110.724 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 57.09 18.48 4.09 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.608 1.163 . . . . 0.0 111.801 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -138.43 7.47 2.59 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.612 1.165 . . . . 0.0 110.376 177.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 65.6 p -150.78 53.38 1.19 Allowed Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.921 0.888 . . . . 0.0 110.41 178.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -70.37 177.31 6.14 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 123.738 2.959 . . . . 0.0 111.448 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.42 172.74 1.07 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.633 0.773 . . . . 0.0 112.143 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -147.5 156.97 43.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.403 177.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 27.4 m -144.52 -172.38 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.091 0 C-N-CA 123.972 0.909 . . . . 0.0 110.002 -176.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -57.21 163.01 2.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.293 0.637 . . . . 0.0 112.283 -178.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -143.88 26.96 1.51 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.779 0.832 . . . . 0.0 110.652 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -57.79 164.72 2.0 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 123.784 0.834 . . . . 0.0 111.805 -178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -143.2 23.31 1.85 Allowed 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 123.713 0.805 . . . . 0.0 111.205 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -67.88 16.91 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.77 1.228 . . . . 0.0 113.895 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -140.7 151.61 44.66 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.408 0.549 . . . . 0.0 110.476 -178.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -64.42 -25.65 68.11 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.968 0.507 . . . . 0.0 112.136 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.48 -34.69 60.14 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.257 -0.737 . . . . 0.0 111.257 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.63 -18.54 60.54 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 117.325 0.562 . . . . 0.0 110.865 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.63 -41.15 27.61 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 62.0 mt -71.02 -41.56 70.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.255 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -70.84 -25.9 63.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.928 -0.482 . . . . 0.0 111.314 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 45.5 t -64.74 -44.82 88.89 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.791 0.723 . . . . 0.0 109.769 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.4 -24.62 65.68 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -105.36 -1.51 25.02 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 122.088 -0.382 . . . . 0.0 111.62 -178.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -79.79 -40.09 29.44 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -66.88 -16.88 64.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 175.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -88.01 -8.34 55.75 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.371 0.668 . . . . 0.0 112.496 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.484 HD11 ' HG2' ' A' ' 12' ' ' PRO . 7.2 tp -123.22 -7.95 7.88 Favored 'Isoleucine or valine' 0 C--N 1.344 0.335 0 CA-C-N 119.334 0.97 . . . . 0.0 112.909 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -80.6 33.62 0.31 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.173 0.589 . . . . 0.0 112.036 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -130.87 175.57 8.95 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 121.113 0.482 . . . . 0.0 111.918 -174.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -64.04 178.05 0.71 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.704 1.201 . . . . 0.0 112.747 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 21.4 m -137.59 156.04 74.96 Favored Pre-proline 0 CA--C 1.53 0.192 0 C-N-CA 122.918 0.487 . . . . 0.0 110.998 -177.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -77.67 -178.86 4.92 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.577 2.851 . . . . 0.0 110.044 173.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -148.65 -1.9 0.5 Allowed 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -66.51 -20.49 66.04 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.939 -0.476 . . . . 0.0 111.905 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 3.1 mpp? -67.93 -36.81 80.77 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 176.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' B' ' 49' ' ' LEU . 82.6 mt -83.43 -12.46 56.38 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 122.117 -0.364 . . . . 0.0 110.213 178.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -72.43 -20.57 61.39 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.937 -0.477 . . . . 0.0 109.882 172.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 67.9 mt -73.63 -19.57 60.82 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 173.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.423 ' C ' ' H ' ' B' ' 54' ' ' LYS . 15.8 mt -78.93 -22.6 45.53 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 120.354 -0.539 . . . . 0.0 110.136 173.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -73.41 9.38 1.35 Allowed 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 172.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' B' ' 52' ' ' LEU . 36.9 ttpt -120.72 -0.55 10.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.064 1.346 . . . . 0.0 110.588 -178.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.2 pp -149.65 -15.36 0.27 Allowed 'General case' 0 C--N 1.345 0.374 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -122.65 5.63 9.49 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.668 0.667 . . . . 0.0 112.399 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.58 ' HG ' ' H ' ' B' ' 58' ' ' GLU . 14.7 tp 56.01 -173.02 0.06 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.304 1.042 . . . . 0.0 111.604 179.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.58 ' H ' ' HG ' ' B' ' 57' ' ' LEU . 44.1 mt-10 -128.47 9.7 6.09 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.782 0.833 . . . . 0.0 111.038 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 95.2 mt -146.45 168.4 21.27 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.756 1.222 . . . . 0.0 108.83 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 39.9 t -144.02 134.6 12.18 Favored Pre-proline 0 CA--C 1.532 0.268 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.61 172.64 15.79 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.798 2.999 . . . . 0.0 111.423 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 51.4 tpt85 . . . . . 0 C--N 1.338 0.093 0 C-N-CA 123.434 0.694 . . . . 0.0 110.089 179.277 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 ttp . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m 47.33 28.68 1.1 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.679 1.191 . . . . 0.0 113.714 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.6 tp -63.42 -30.56 71.67 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 122.186 -0.321 . . . . 0.0 111.488 -177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -65.66 -35.42 91.06 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -179.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.3 mp0 -73.4 3.33 6.11 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.399 0.68 . . . . 0.0 111.115 177.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -128.42 0.58 5.65 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.283 0.633 . . . . 0.0 111.078 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.66 -39.54 2.74 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 122.952 0.501 . . . . 0.0 111.091 177.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.427 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -57.99 -44.78 99.62 Favored Pre-proline 0 CA--C 1.53 0.209 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -175.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 82.9 Cg_endo -75.71 3.48 5.93 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.173 1.916 . . . . 0.0 111.907 -179.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -130.28 9.42 5.19 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.9 mt -54.86 -44.24 99.29 Favored Pre-proline 0 CA--C 1.537 0.469 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.58 -15.0 11.24 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 121.715 1.61 . . . . 0.0 112.708 -175.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -71.59 -25.33 62.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.462 0.573 . . . . 0.0 111.221 -178.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.9 mt -69.53 -27.32 65.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 118.145 0.429 . . . . 0.0 110.009 177.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -88.76 -29.18 19.98 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.53 0.732 . . . . 0.0 110.544 -179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.5 ttp180 -53.83 -25.58 20.2 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.674 1.19 . . . . 0.0 112.759 -175.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -140.56 -20.98 0.83 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 176.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.25 -27.99 70.09 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -69.26 -33.01 72.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 117.557 0.679 . . . . 0.0 110.289 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.95 -11.44 59.9 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.0 mt -86.07 4.39 38.34 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.03 0.377 . . . . 0.0 111.213 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.8 t -149.31 -18.13 0.28 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.97 11.24 82.87 Favored Glycine 0 CA--C 1.526 0.719 0 CA-C-O 119.47 -0.628 . . . . 0.0 113.75 171.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -148.28 140.03 23.79 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 118.349 1.075 . . . . 0.0 110.864 -179.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -73.36 -19.22 61.06 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.365 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -73.72 -37.68 65.05 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 178.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -79.67 -32.59 41.49 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 176.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -65.4 -47.1 82.49 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 178.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.81 -33.02 74.73 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 117.594 0.697 . . . . 0.0 110.313 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.496 ' HE3' ' CE1' ' A' ' 31' ' ' TYR . 5.9 tmmm? -67.5 -46.78 71.93 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.63 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.496 ' CE1' ' HE3' ' A' ' 30' ' ' LYS . 22.7 m-85 -69.06 -36.07 77.24 Favored 'General case' 0 N--CA 1.457 -0.102 0 CA-C-N 118.392 0.542 . . . . 0.0 111.552 -178.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.8 t -60.81 -52.25 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.17 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -77.29 -27.83 53.14 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 122.423 -0.173 . . . . 0.0 111.375 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.04 -24.24 63.23 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.721 -0.181 . . . . 0.0 110.847 175.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.0 m -67.82 -40.08 83.83 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.3 OUTLIER -73.59 -42.25 61.81 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.138 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -59.63 -25.49 64.71 Favored 'General case' 0 C--N 1.338 0.079 0 O-C-N 121.995 -0.44 . . . . 0.0 111.858 179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 0.49 31.33 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 122.797 0.439 . . . . 0.0 111.011 178.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 81.6 mt -120.9 -13.89 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.157 0.983 . . . . 0.0 109.932 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -61.79 -10.64 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.87 0.868 . . . . 0.0 111.708 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.7 3.0 9.55 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.001 0.52 . . . . 0.0 111.296 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.1 55.36 0.97 Allowed Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 123.385 0.674 . . . . 0.0 110.304 -177.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.47 -10.63 28.45 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 123.318 2.679 . . . . 0.0 112.753 -173.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -81.52 -11.69 59.09 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 122.067 -0.395 . . . . 0.0 111.005 177.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -86.73 -14.61 41.92 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -65.31 114.9 17.26 Favored Pre-proline 0 CA--C 1.529 0.165 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -78.78 135.29 12.64 Favored 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 122.991 2.461 . . . . 0.0 112.193 -174.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -125.76 1.91 7.45 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 125.054 1.342 . . . . 0.0 109.976 175.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -79.42 9.56 4.67 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.086 0.954 . . . . 0.0 111.719 -178.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.3 m -137.93 -179.08 2.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 C-N-CA 123.846 0.858 . . . . 0.0 109.967 -176.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -52.65 152.96 6.07 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 123.301 0.641 . . . . 0.0 110.81 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -67.78 7.3 0.59 Allowed 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 124.383 3.389 . . . . 0.0 112.588 -176.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -127.17 -25.02 3.32 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.221 0.608 . . . . 0.0 110.843 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 54' ' ' LEU . 28.7 mt -70.31 -33.9 72.08 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.039 0.381 . . . . 0.0 110.648 178.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.97 -41.0 93.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.62 -42.47 91.5 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.975 0.51 . . . . 0.0 109.977 177.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -77.47 -30.25 53.07 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 112.253 0.464 . . . . 0.0 112.253 -175.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -66.12 -41.99 89.76 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.71 0.687 . . . . 0.0 110.754 179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.1 mmm -71.12 -34.76 71.37 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.502 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -71.0 -35.07 71.94 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 117.618 0.19 . . . . 0.0 110.752 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.25 -27.65 68.8 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.516 0.326 . . . . 0.0 110.204 177.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -72.71 -36.39 58.23 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 178.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -70.59 -38.24 72.68 Favored 'Isoleucine or valine' 0 C--N 1.338 0.101 0 CA-C-N 117.657 0.729 . . . . 0.0 110.142 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 76.0 t90 -69.29 -32.04 70.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 122.251 -0.281 . . . . 0.0 110.897 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.82 -32.94 68.08 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 122.099 -0.376 . . . . 0.0 110.179 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -74.11 -25.49 59.81 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.597 0.359 . . . . 0.0 110.484 178.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.2 -44.38 65.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 122.392 -0.192 . . . . 0.0 110.626 179.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -69.79 -16.52 63.3 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 122.115 -0.366 . . . . 0.0 110.614 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.48 7.51 46.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.23 0.612 . . . . 0.0 111.208 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -134.24 -4.89 2.68 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 111.66 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 112.88 25.56 4.46 Favored Glycine 0 C--N 1.341 0.825 0 C-N-CA 120.911 -0.662 . . . . 0.0 114.372 173.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -128.64 171.53 12.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 118.558 1.179 . . . . 0.0 110.637 -179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 51.01 25.69 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.195 0.998 . . . . 0.0 112.576 -176.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -67.51 -7.19 23.85 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -152.42 -19.87 0.17 Allowed 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.292 0.496 . . . . 0.0 111.706 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.0 m 49.85 26.4 1.92 Allowed 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -56.54 153.12 10.63 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.767 0.427 . . . . 0.0 110.071 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.4 p -136.47 170.68 15.66 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.791 0.436 . . . . 0.0 110.922 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -152.92 23.3 0.57 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.946 0.498 . . . . 0.0 111.291 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.72 162.03 2.51 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.958 -0.464 . . . . 0.0 111.734 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.25 -13.55 62.33 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -173.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 151.62 20.39 0.06 OUTLIER Glycine 0 CA--C 1.527 0.791 0 CA-C-O 119.421 -0.655 . . . . 0.0 113.448 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 8.9 t -134.18 5.45 3.54 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.304 1.052 . . . . 0.0 112.322 -176.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -150.97 -30.1 0.19 Allowed 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 174.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.42 -22.79 65.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.6 p -71.53 -29.9 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.586 0.354 . . . . 0.0 110.328 176.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.71 7.7 28.94 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.774 0.83 . . . . 0.0 111.568 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -127.97 -40.37 1.7 Allowed 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.389 0.676 . . . . 0.0 110.062 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -69.2 -1.77 8.76 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 122.525 0.33 . . . . 0.0 111.786 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 63.6 mtt180 -130.84 -3.0 4.1 Favored 'General case' 0 C--O 1.226 -0.147 0 C-N-CA 123.022 0.529 . . . . 0.0 111.926 -179.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.429 HD21 HD13 ' A' ' 137' ' ' ILE . 73.6 mt -136.35 14.59 3.24 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.362 0.528 . . . . 0.0 111.51 -172.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.79 18.64 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.424 1.09 . . . . 0.0 112.124 176.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 91' ' ' LEU . 85.2 mmt-85 -126.34 11.28 7.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.373 0.669 . . . . 0.0 112.064 -174.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 20.4 ptp -122.78 164.5 18.24 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 117.921 0.328 . . . . 0.0 110.304 175.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 63.5 m -62.45 143.29 96.09 Favored Pre-proline 0 CA--C 1.532 0.256 0 C-N-CA 123.258 0.623 . . . . 0.0 110.286 -176.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -53.06 -0.62 0.07 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 124.95 3.767 . . . . 0.0 115.139 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 31.1 tp -119.47 -19.44 8.18 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 118.406 0.548 . . . . 0.0 110.564 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.6 m -69.1 -27.72 65.85 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 175.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 mtp-105 -69.9 -26.79 64.33 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 122.525 0.33 . . . . 0.0 110.16 177.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -81.06 -39.34 25.9 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.13 -34.36 77.88 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 177.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.15 -49.26 68.03 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.557 0.343 . . . . 0.0 110.812 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.71 -4.65 35.8 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.423 HD21 ' HA ' ' A' ' 115' ' ' ALA . 14.7 tp -106.64 -4.44 19.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.817 0.447 . . . . 0.0 111.772 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 72.8 p -140.11 5.02 2.08 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -178.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -126.9 -1.06 6.61 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.587 0.631 . . . . 0.0 112.541 178.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.433 ' HE2' ' HB2' ' B' ' 32' ' ' LEU . 8.3 ptp -150.71 12.27 0.69 Allowed 'General case' 0 C--N 1.338 0.091 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -143.75 -12.26 0.67 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.723 0.692 . . . . 0.0 111.995 176.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 67.2 15.07 64.92 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.994 -0.892 . . . . 0.0 114.135 173.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -60.93 146.68 45.91 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.844 1.322 . . . . 0.0 110.231 178.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.7 m -65.98 153.51 91.46 Favored Pre-proline 0 N--CA 1.454 -0.24 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 176.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -68.51 -17.26 43.56 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.555 2.17 . . . . 0.0 111.24 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -74.93 -34.39 62.1 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 117.847 0.294 . . . . 0.0 110.711 178.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -82.26 -34.54 28.73 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.423 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -67.0 -27.48 67.47 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.437 0.295 . . . . 0.0 110.698 175.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.71 -32.91 53.23 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -70.46 -23.53 62.71 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.397 0.679 . . . . 0.0 111.213 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.8 tp -88.82 -5.32 58.12 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -177.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 16.9 pt -135.13 12.07 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 O-C-N 121.875 -0.515 . . . . 0.0 111.071 176.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 54.42 58.22 5.12 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.898 1.279 . . . . 0.0 113.566 176.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.47 -178.71 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.807 0.843 . . . . 0.0 109.816 176.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -83.96 160.79 20.98 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 28.3 m -58.67 -36.96 74.99 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 122.018 -0.427 . . . . 0.0 110.912 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 97.6 p -72.66 -20.93 61.16 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -76.27 -33.38 59.12 Favored 'General case' 0 N--CA 1.455 -0.19 0 O-C-N 121.97 -0.456 . . . . 0.0 110.084 178.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.9 t -66.22 -37.56 79.98 Favored 'Isoleucine or valine' 0 C--N 1.338 0.102 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.69 -32.19 73.22 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.444 0.164 . . . . 0.0 110.858 177.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 90.4 m -76.1 -39.43 55.27 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.515 177.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 6.1 mp -66.44 -33.78 76.47 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 119.224 -0.417 . . . . 0.0 111.456 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.2 m -78.5 -26.44 13.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.138 0 CA-C-N 118.765 0.711 . . . . 0.0 111.12 177.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 60.7 m -68.45 -40.08 81.22 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -74.1 -27.42 60.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 176.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -72.8 -48.68 36.0 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 122.473 -0.142 . . . . 0.0 110.653 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 117.909 0.322 . . . . 0.0 111.731 -177.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.82 -41.0 62.93 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 174.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -72.35 -22.24 61.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 119.513 -0.279 . . . . 0.0 110.461 178.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.429 HD13 HD21 ' A' ' 91' ' ' LEU . 12.7 mm -75.29 -44.3 42.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.514 0.597 . . . . 0.0 109.745 176.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -69.51 -20.48 63.71 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -94.7 -8.02 38.99 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -172.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -155.29 -12.06 0.11 Allowed 'General case' 0 C--N 1.34 0.193 0 N-CA-C 116.056 1.873 . . . . 0.0 116.056 -175.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 41.1 p -64.2 -14.24 54.08 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 119.941 1.246 . . . . 0.0 112.354 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.425 ' CD ' ' H ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -77.89 2.78 16.28 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 178.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -145.62 175.45 10.36 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.4 0.68 . . . . 0.0 110.065 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.43 13.29 0.65 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -177.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -140.19 167.62 21.7 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.053 0.454 . . . . 0.0 111.157 -178.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 37.6 tp -156.56 168.46 27.3 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.202 1.001 . . . . 0.0 108.682 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 30.6 m -139.35 153.77 71.21 Favored Pre-proline 0 CA--C 1.531 0.233 0 C-N-CA 123.034 0.534 . . . . 0.0 110.129 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.98 172.78 14.76 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 123.992 3.128 . . . . 0.0 111.461 178.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 40.0 ptt180 -152.75 -178.87 7.15 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.793 0.837 . . . . 0.0 110.156 179.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -163.48 175.81 39.68 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 89.5 p -152.77 15.79 0.57 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 122.944 0.497 . . . . 0.0 111.399 -177.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 66.1 t60 53.22 21.03 2.06 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.696 0.798 . . . . 0.0 111.913 -175.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 54.4 m80 52.22 20.41 1.34 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.656 1.182 . . . . 0.0 113.216 -178.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 47.7 t60 -150.01 10.52 0.71 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.708 0.403 . . . . 0.0 111.057 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 60.2 t60 52.65 21.38 1.84 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.48 1.112 . . . . 0.0 112.463 -177.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -70.68 -8.49 52.36 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.23 0.612 . . . . 0.0 111.768 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 77.0 t60 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 117.157 -1.402 . . . . 0.0 110.102 -179.399 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -152.37 20.36 0.64 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.862 0.465 . . . . 0.0 111.946 -177.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -132.31 11.27 4.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -174.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.62 159.6 59.78 Favored Pre-proline 0 CA--C 1.533 0.303 0 O-C-N 121.854 -0.529 . . . . 0.0 109.666 176.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.3 -22.86 12.4 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 124.083 3.189 . . . . 0.0 113.679 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 165.35 164.32 20.51 Favored Glycine 0 CA--C 1.528 0.879 0 N-CA-C 110.859 -0.896 . . . . 0.0 110.859 176.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -160.8 -28.91 0.06 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 122.813 0.445 . . . . 0.0 111.266 178.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -156.52 17.69 0.33 Allowed 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 122.971 0.508 . . . . 0.0 111.724 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -140.17 15.48 2.43 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.634 0.374 . . . . 0.0 111.245 -175.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -142.13 -8.67 0.9 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.838 0.455 . . . . 0.0 111.043 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 49.36 19.61 0.36 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.149 1.38 . . . . 0.0 113.266 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -157.22 155.63 31.18 Favored 'General case' 0 C--N 1.333 -0.137 0 O-C-N 122.066 -0.396 . . . . 0.0 111.02 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 80.2 p -160.12 0.26 0.07 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.846 0.458 . . . . 0.0 112.068 177.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 44.8 m -145.35 13.46 1.4 Allowed 'General case' 0 C--N 1.342 0.242 0 C-N-CA 122.756 0.422 . . . . 0.0 112.025 -174.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -76.08 33.07 0.12 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.269 0.628 . . . . 0.0 112.254 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -140.63 163.91 31.59 Favored 'General case' 0 C--O 1.231 0.096 0 C-N-CA 123.688 0.795 . . . . 0.0 110.081 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 55.7 p -154.63 54.1 0.99 Allowed Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -177.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.61 169.87 17.7 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.778 2.319 . . . . 0.0 110.395 177.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -149.55 177.55 9.63 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.851 0.358 . . . . 0.0 111.557 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 44.9 pttt -154.4 21.53 0.48 Allowed 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.777 0.831 . . . . 0.0 111.606 -173.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 34.3 m -134.66 179.02 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 C-N-CA 123.308 0.643 . . . . 0.0 110.925 -174.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 25.8 pt20 -56.94 165.3 1.29 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.896 0.878 . . . . 0.0 112.757 -178.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 9.4 t -149.55 23.28 0.9 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.576 0.75 . . . . 0.0 110.469 -178.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -137.12 174.03 11.06 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 123.666 0.787 . . . . 0.0 110.001 -177.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -144.59 3.06 1.11 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -152.42 136.92 16.8 Favored 'General case' 0 C--N 1.339 0.128 0 O-C-N 122.19 -0.319 . . . . 0.0 110.376 179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -160.54 4.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.148 0.579 . . . . 0.0 111.562 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.7 tpt -58.5 -26.6 63.62 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -174.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -70.43 -34.24 68.28 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.8 -22.16 43.41 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 117.285 0.543 . . . . 0.0 110.541 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -43.98 71.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.816 0.341 . . . . 0.0 110.099 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.433 ' HB2' ' HE2' ' A' ' 107' ' ' MET . 90.7 mt -74.78 -31.62 61.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.219 178.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -67.72 -37.66 82.53 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 117.94 0.336 . . . . 0.0 110.42 178.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 34.5 t -65.86 -37.23 85.64 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 117.833 0.288 . . . . 0.0 110.499 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.74 -29.12 68.26 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -102.23 -14.08 17.15 Favored 'General case' 0 N--CA 1.457 -0.103 0 O-C-N 122.083 -0.386 . . . . 0.0 111.585 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 61.0 tp60 -66.99 -36.76 82.89 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.78 -31.96 70.16 Favored 'General case' 0 N--CA 1.457 -0.096 0 C-N-CA 122.621 0.368 . . . . 0.0 110.791 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 96.1 m -73.68 -8.95 58.02 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.228 0.611 . . . . 0.0 112.327 -178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 16.7 tt -123.54 -7.18 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 118.77 0.714 . . . . 0.0 111.776 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.11 24.38 0.13 Allowed 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.406 -0.809 . . . . 0.0 110.714 171.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -131.94 171.92 12.98 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.485 0.714 . . . . 0.0 111.179 -175.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -67.54 -177.34 0.73 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.399 1.079 . . . . 0.0 112.113 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 35.2 m -132.39 150.36 75.72 Favored Pre-proline 0 CA--C 1.529 0.171 0 C-N-CA 123.809 0.844 . . . . 0.0 109.231 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -79.29 -25.98 5.39 Favored 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.169 2.58 . . . . 0.0 113.051 -175.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 33.8 t70 51.89 4.07 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.881 1.272 . . . . 0.0 114.015 -176.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -66.0 -22.12 66.44 Favored 'General case' 0 CA--C 1.528 0.108 0 O-C-N 121.461 -0.774 . . . . 0.0 111.243 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 27.6 mtm -70.71 -34.2 71.68 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.661 0.384 . . . . 0.0 111.017 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 71.7 mt -82.52 -15.03 53.87 Favored 'General case' 0 N--CA 1.454 -0.246 0 O-C-N 121.888 -0.507 . . . . 0.0 109.884 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -70.31 -20.49 63.01 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 121.995 -0.441 . . . . 0.0 109.837 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 55.4 mt -73.03 -14.7 61.47 Favored 'General case' 0 C--N 1.338 0.108 0 O-C-N 122.192 -0.318 . . . . 0.0 110.655 173.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.427 ' C ' ' H ' ' B' ' 54' ' ' LYS . 31.1 mt -86.72 -20.93 26.97 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 119.599 -0.238 . . . . 0.0 111.093 173.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -69.84 16.23 0.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.705 0.402 . . . . 0.0 111.928 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.427 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.3 pttt -135.04 5.41 3.3 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.724 0.81 . . . . 0.0 111.175 177.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.425 HD12 ' C ' ' B' ' 55' ' ' LEU . 2.5 pp -151.52 -2.73 0.31 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 177.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -144.48 170.01 16.87 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.426 0.557 . . . . 0.0 110.101 175.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -153.95 140.4 18.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -178.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -147.75 160.83 42.3 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.414 0.686 . . . . 0.0 109.926 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 97.0 mt -146.47 175.58 10.45 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 123.646 0.778 . . . . 0.0 110.132 -175.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 14.6 p -149.66 140.33 14.02 Favored Pre-proline 0 CA--C 1.532 0.266 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -70.53 167.05 26.55 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.014 2.476 . . . . 0.0 111.405 178.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 51.3 tpt85 . . . . . 0 N--CA 1.457 -0.1 0 C-N-CA 123.301 0.641 . . . . 0.0 110.403 -179.826 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.4 t -154.58 165.54 36.16 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 123.516 0.726 . . . . 0.0 109.409 178.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 51.6 tp -60.98 -35.75 77.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 121.974 0.11 . . . . 0.0 111.099 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.85 -29.16 67.63 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.168 -177.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -74.91 0.91 14.1 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.545 0.738 . . . . 0.0 110.251 176.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -137.12 8.37 2.95 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.419 1.088 . . . . 0.0 110.687 -178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 19.6 tp -118.31 -38.89 3.1 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.223 0.609 . . . . 0.0 110.622 175.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.433 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.77 -44.58 97.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.433 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 95.8 Cg_endo -74.09 -0.22 9.27 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.282 1.988 . . . . 0.0 112.631 -176.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.422 ' CE1' ' HE ' ' A' ' 53' ' ' ARG . 39.1 m-70 -133.67 3.17 3.52 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.017 0.527 . . . . 0.0 111.158 -178.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.433 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 55.2 tp -59.64 -43.49 95.63 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 124.632 1.173 . . . . 0.0 113.786 -177.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.433 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 92.8 Cg_endo -75.0 -10.67 21.32 Favored 'Trans proline' 0 N--CA 1.453 -0.861 0 C-N-CA 121.741 1.628 . . . . 0.0 112.367 -176.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 19.0 m-30 -66.57 -22.59 66.14 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 118.594 0.634 . . . . 0.0 111.365 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -74.05 -17.15 61.01 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 122.209 -0.307 . . . . 0.0 110.557 177.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.7 ttt85 -105.06 -26.25 12.2 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 122.763 0.425 . . . . 0.0 111.221 -175.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -61.68 -19.6 62.52 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 122.877 0.471 . . . . 0.0 111.647 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -136.83 -11.88 1.75 Allowed 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.423 0.289 . . . . 0.0 111.143 175.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.27 -38.64 96.55 Favored Glycine 0 C--N 1.338 0.68 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 177.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.9 mtm105 -68.69 -24.9 64.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.105 0.953 . . . . 0.0 110.423 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.42 4.15 36.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.691 0.797 . . . . 0.0 111.253 177.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.0 tp -126.74 4.59 6.69 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.979 0.912 . . . . 0.0 110.297 179.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.3 p -135.81 -9.52 2.1 Favored 'General case' 0 C--N 1.338 0.078 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.76 2.36 44.41 Favored Glycine 0 CA--C 1.529 0.934 0 CA-C-O 119.494 -0.615 . . . . 0.0 114.093 173.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 38.0 t -157.03 140.08 15.38 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 118.262 1.031 . . . . 0.0 110.857 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -66.54 -20.99 66.16 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.207 177.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -78.81 -32.03 46.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -79.01 -40.24 31.98 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.45 -32.31 83.72 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 178.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -71.88 -39.71 69.43 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 117.129 0.465 . . . . 0.0 111.264 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -26.43 30.77 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 120.458 -0.497 . . . . 0.0 112.122 -177.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -69.17 -35.43 76.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 119.097 0.862 . . . . 0.0 110.059 176.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.0 t -65.01 -43.71 96.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.147 0 CA-C-O 120.643 0.259 . . . . 0.0 110.526 176.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.3 ttp-105 -78.76 -28.48 44.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 122.302 -0.249 . . . . 0.0 111.661 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.57 -29.73 65.05 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 65.0 m -65.15 -37.88 88.82 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.4 OUTLIER -77.8 -42.72 32.88 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 -177.037 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -63.41 -24.66 67.94 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.795 -0.565 . . . . 0.0 110.475 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.14 -0.08 26.9 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.406 0.682 . . . . 0.0 111.528 176.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 92.2 mt -120.24 -15.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.836 0.854 . . . . 0.0 109.696 -179.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.02 -14.37 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.367 0.667 . . . . 0.0 110.775 173.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.85 4.41 9.43 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.679 0.792 . . . . 0.0 110.937 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.28 55.5 1.41 Allowed Pre-proline 0 CA--C 1.534 0.34 0 C-N-CA 123.33 0.652 . . . . 0.0 111.494 -177.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -68.43 -4.72 13.48 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.368 2.045 . . . . 0.0 110.868 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -85.81 4.11 38.53 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.2 1.0 . . . . 0.0 111.662 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -131.26 20.88 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.119 0.418 . . . . 0.0 111.358 178.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -131.83 53.67 12.09 Favored Pre-proline 0 CA--C 1.534 0.331 0 C-N-CA 123.457 0.703 . . . . 0.0 110.073 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.77 171.72 17.67 Favored 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 124.148 3.232 . . . . 0.0 112.752 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.416 ' C ' ' H ' ' A' ' 50' ' ' VAL . 5.1 mpt_? -113.08 18.82 17.72 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.179 1.392 . . . . 0.0 110.126 175.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.09 4.41 0.9 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.989 0.916 . . . . 0.0 110.809 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.416 ' H ' ' C ' ' A' ' 48' ' ' ARG . 30.4 m -135.73 177.75 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 125.462 1.505 . . . . 0.0 108.494 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -57.93 148.47 59.46 Favored Pre-proline 0 C--O 1.232 0.173 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -70.33 10.69 0.53 Allowed 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 123.793 2.995 . . . . 0.0 111.666 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HE ' ' CE1' ' A' ' 10' ' ' HIS . 98.9 mtt180 -126.52 -16.67 5.27 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 124.029 0.932 . . . . 0.0 110.613 177.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.96 -45.3 64.36 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.47 -32.83 82.89 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.68 -50.08 74.38 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.227 -0.656 . . . . 0.0 109.227 178.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -76.71 -29.64 56.34 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.572 -176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 31.9 tpt85 -68.14 -42.03 80.75 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 119.671 -0.204 . . . . 0.0 111.145 -176.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 96.4 mmm -79.41 -31.31 42.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.994 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -68.02 -38.82 83.01 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.939 0.336 . . . . 0.0 110.212 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 22.6 tm0? -70.74 -25.2 62.82 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 122.506 0.322 . . . . 0.0 110.199 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.77 -39.75 85.66 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.4 mm -72.34 -36.75 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.109 0 CA-C-N 118.194 0.997 . . . . 0.0 109.698 178.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -68.71 -35.61 77.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 122.522 -0.111 . . . . 0.0 110.916 -177.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.44 -31.12 66.84 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 176.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.5 t -72.48 -28.01 62.64 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -76.05 -36.7 58.93 Favored 'General case' 0 N--CA 1.454 -0.25 0 O-C-N 122.384 -0.198 . . . . 0.0 110.549 177.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -73.51 -14.07 61.15 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 122.298 -0.251 . . . . 0.0 110.488 175.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -95.18 9.49 39.48 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.426 0.691 . . . . 0.0 110.458 176.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.3 -8.52 3.35 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.076 0.551 . . . . 0.0 111.056 -178.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 149.91 -22.46 1.14 Allowed Glycine 0 CA--C 1.526 0.758 0 CA-C-O 119.311 -0.716 . . . . 0.0 114.708 173.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.07 140.01 58.78 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 118.424 1.112 . . . . 0.0 110.771 -177.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -174.54 15.65 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.655 0.782 . . . . 0.0 111.516 178.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -84.28 170.91 13.19 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.11 0.481 . . . . 0.0 110.699 -176.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.2 t -64.13 152.7 39.84 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.005 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.7 p -164.33 9.25 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -175.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -63.51 -11.02 20.72 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 -169.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 60.7 p -158.7 167.59 29.12 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.944 0.793 . . . . 0.0 112.05 178.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -149.31 19.11 0.95 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.135 0.974 . . . . 0.0 110.522 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.29 -171.57 3.87 Favored 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 123.481 0.712 . . . . 0.0 109.918 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -134.02 12.11 3.94 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.802 0.441 . . . . 0.0 111.604 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -163.9 9.56 0.08 OUTLIER Glycine 0 CA--C 1.53 0.97 0 CA-C-O 119.702 -0.499 . . . . 0.0 114.054 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 t -148.0 -0.25 0.61 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.106 0.953 . . . . 0.0 111.71 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -141.95 -36.16 0.43 Allowed 'General case' 0 C--O 1.228 -0.056 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.05 -28.79 69.11 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 175.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.06 -32.39 54.3 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 CA-C-O 120.738 0.304 . . . . 0.0 110.561 178.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -87.23 0.09 55.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.42 0.688 . . . . 0.0 112.296 -175.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -132.26 -12.21 3.18 Favored 'General case' 0 C--O 1.227 -0.119 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 177.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.3 -3.42 36.61 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 173.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.507 ' C ' HD22 ' A' ' 91' ' ' LEU . 70.9 mtt85 -122.62 -12.49 8.11 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 123.75 0.82 . . . . 0.0 111.03 177.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.507 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.4 mm? -134.8 36.04 3.1 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.661 1.184 . . . . 0.0 110.085 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.412 ' C ' ' HD2' ' A' ' 93' ' ' ARG . . . -61.19 9.23 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.412 ' HD2' ' C ' ' A' ' 92' ' ' ALA . 2.8 mpt_? -130.42 0.42 4.52 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 118.922 0.783 . . . . 0.0 111.798 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.5 ttm -69.28 144.07 53.69 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 118.569 0.622 . . . . 0.0 109.797 177.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.441 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 24.2 m -67.19 137.47 94.19 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 123.052 0.541 . . . . 0.0 110.74 -178.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 50.6 Cg_exo -55.5 2.98 0.07 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 125.133 3.888 . . . . 0.0 115.448 176.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -128.63 -33.75 2.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 118.816 0.735 . . . . 0.0 109.937 -176.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 51.0 m -64.91 -25.42 67.88 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 121.922 -0.486 . . . . 0.0 110.115 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.6 tpp85 -70.46 -29.56 66.15 Favored 'General case' 0 C--N 1.34 0.178 0 C-N-CA 122.563 0.345 . . . . 0.0 110.413 175.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -72.71 -37.85 67.67 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.66 -31.56 68.52 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.082 -0.386 . . . . 0.0 110.173 176.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.49 -47.01 77.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.17 -11.16 60.43 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.712 -0.617 . . . . 0.0 111.544 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 65.2 mt -91.4 -5.1 54.95 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 122.103 -0.373 . . . . 0.0 111.627 174.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 68.5 p -135.55 6.32 3.23 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -141.58 7.91 1.94 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.059 0.544 . . . . 0.0 111.229 177.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 3.6 mtm -146.61 -2.1 0.67 Allowed 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -176.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -150.18 -17.59 0.25 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.919 0.781 . . . . 0.0 112.17 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 74.4 16.31 79.97 Favored Glycine 0 C--N 1.34 0.784 0 CA-C-O 119.345 -0.697 . . . . 0.0 114.005 173.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -61.27 149.88 36.49 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.639 1.22 . . . . 0.0 110.192 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 48.8 m -73.73 156.0 88.65 Favored Pre-proline 0 C--O 1.232 0.162 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -53.15 -27.18 36.14 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 123.198 2.598 . . . . 0.0 113.248 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -71.13 -33.89 70.52 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.938 -0.476 . . . . 0.0 110.798 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -83.53 -35.54 24.73 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -69.66 -29.6 67.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.148 0.179 . . . . 0.0 111.351 178.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -78.18 -32.93 50.32 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.574 0.226 . . . . 0.0 110.662 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -69.11 -30.87 69.24 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.105 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 52.5 mt -75.51 -6.5 50.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 10.1 pt -135.24 11.2 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 118.796 0.725 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 53.78 56.18 7.51 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.857 1.263 . . . . 0.0 113.955 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.4 m -135.98 176.08 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 C-N-CA 123.455 0.702 . . . . 0.0 110.183 175.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -73.31 156.77 38.09 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-O 120.859 0.362 . . . . 0.0 110.333 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 33.3 m -60.48 -35.9 77.02 Favored 'General case' 0 N--CA 1.456 -0.172 0 O-C-N 121.95 -0.469 . . . . 0.0 110.978 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 89.5 p -75.54 -21.3 58.05 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.976 -0.453 . . . . 0.0 111.512 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -74.44 -43.13 57.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.365 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.7 p -67.25 -29.6 46.41 Favored 'Isoleucine or valine' 0 C--N 1.339 0.143 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.221 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -63.38 -33.86 76.45 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.1 m -75.94 -36.23 59.43 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.3 mp -66.4 -35.1 79.48 Favored 'General case' 0 CA--C 1.527 0.094 0 O-C-N 122.195 -0.315 . . . . 0.0 111.546 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 35.7 m -79.15 -26.59 13.1 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 118.442 0.564 . . . . 0.0 111.02 178.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 51.9 m -67.13 -35.49 79.85 Favored 'General case' 0 N--CA 1.456 -0.162 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 177.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -81.01 -25.06 37.5 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 122.478 -0.139 . . . . 0.0 110.873 178.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.83 -43.6 68.22 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 122.189 -0.319 . . . . 0.0 110.229 179.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -74.84 -22.23 58.81 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.177 0.191 . . . . 0.0 110.748 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.37 -34.84 73.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -75.73 -22.89 56.13 Favored 'General case' 0 N--CA 1.457 -0.116 0 O-C-N 122.289 -0.257 . . . . 0.0 110.54 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 13.0 mm -73.49 -52.52 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.148 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -69.83 -20.5 63.43 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -175.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -72.02 -20.69 61.66 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.464 ' C ' ' H ' ' A' ' 142' ' ' ARG . 22.4 pt20 -154.06 -37.82 0.1 Allowed 'General case' 0 N--CA 1.458 -0.067 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -173.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 56.4 p 47.26 -9.61 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 126.274 1.83 . . . . 0.0 115.796 -168.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.464 ' H ' ' C ' ' A' ' 140' ' ' GLN . 0.1 OUTLIER -165.98 -33.64 0.03 OUTLIER 'General case' 0 C--N 1.342 0.247 0 CA-C-N 119.914 1.234 . . . . 0.0 112.367 172.313 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . 0.422 ' H ' ' HD3' ' A' ' 142' ' ' ARG . . . -171.48 171.87 5.31 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.393 0.677 . . . . 0.0 110.465 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -151.79 157.68 42.28 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.622 0.769 . . . . 0.0 109.36 175.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -154.71 10.21 0.35 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 122.039 0.136 . . . . 0.0 111.34 -176.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 58.2 tp -146.09 112.36 5.81 Favored 'General case' 0 N--CA 1.456 -0.138 0 O-C-N 121.717 -0.615 . . . . 0.0 110.542 -177.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 25.1 t -146.35 77.15 11.81 Favored Pre-proline 0 CA--C 1.53 0.208 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 178.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.42 6.1 1.03 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 124.673 3.582 . . . . 0.0 113.387 -172.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 94.7 mtm-85 -138.25 21.45 2.78 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.14 0.576 . . . . 0.0 111.328 -178.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -161.17 20.31 0.21 Allowed Glycine 0 CA--C 1.529 0.938 0 CA-C-O 119.191 -0.783 . . . . 0.0 113.562 -177.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 73.7 m -140.61 10.99 2.27 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.357 1.079 . . . . 0.0 112.478 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 28.8 p80 -152.51 171.09 18.64 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.076 0.398 . . . . 0.0 110.733 178.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -144.07 5.41 1.31 Allowed 'General case' 0 C--O 1.232 0.156 0 C-N-CA 123.357 0.663 . . . . 0.0 111.067 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 64.6 t60 -156.22 164.55 38.22 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.313 0.645 . . . . 0.0 109.892 -178.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -154.61 172.04 18.5 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 122.877 0.471 . . . . 0.0 110.767 -178.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -146.61 7.08 0.96 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.959 0.504 . . . . 0.0 110.953 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 63.1 m80 . . . . . 0 C--O 1.253 1.242 0 CA-C-O 117.122 -1.418 . . . . 0.0 110.201 -178.042 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.477 0.88 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 20.3 tp -147.08 8.89 0.96 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.654 0.381 . . . . 0.0 110.829 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.1 t70 58.04 15.93 3.49 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.182 0.993 . . . . 0.0 112.791 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 7.3 mp -122.99 157.85 59.21 Favored Pre-proline 0 CA--C 1.529 0.161 0 C-N-CA 123.94 0.896 . . . . 0.0 109.056 177.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -73.11 -6.44 18.95 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 123.731 2.954 . . . . 0.0 112.178 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 174.62 173.79 40.81 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 178.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -154.39 -4.7 0.16 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 26.0 pttm 43.21 29.98 0.26 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.238 1.415 . . . . 0.0 113.846 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -150.4 168.0 25.43 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.03 0.532 . . . . 0.0 110.801 -176.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -154.87 16.75 0.44 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 178.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -146.49 0.4 0.78 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -175.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.16 8.93 2.07 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 121.638 -0.664 . . . . 0.0 111.328 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 84.6 p -150.34 12.13 0.72 Allowed 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.185 0.594 . . . . 0.0 111.056 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 28.9 t -148.81 170.53 18.02 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.534 0.733 . . . . 0.0 109.464 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -151.53 163.3 39.33 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.813 0.445 . . . . 0.0 110.116 -176.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -60.32 166.88 2.74 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.856 0.862 . . . . 0.0 110.372 177.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 31.2 t -137.21 145.13 48.66 Favored Pre-proline 0 N--CA 1.455 -0.183 0 C-N-CA 123.537 0.735 . . . . 0.0 109.621 -177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -74.16 5.12 3.76 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 124.039 3.159 . . . . 0.0 112.541 -179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . 57.78 -170.87 0.1 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.084 0.954 . . . . 0.0 112.377 -177.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 44.4 31.7 0.62 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.626 1.571 . . . . 0.0 113.465 -174.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 27.3 m -138.28 170.9 16.18 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.082 0 C-N-CA 123.961 0.904 . . . . 0.0 109.516 176.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 84.0 mm-40 53.7 21.0 2.43 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.821 0.848 . . . . 0.0 112.205 -175.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 87.4 p -146.52 13.13 1.2 Allowed 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.648 0.779 . . . . 0.0 111.109 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.97 14.78 2.87 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 124.312 1.045 . . . . 0.0 110.756 -175.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -65.35 -11.06 38.41 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.056 0.542 . . . . 0.0 111.715 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 44.9 ttm105 -161.07 143.55 12.46 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 123.309 0.643 . . . . 0.0 110.009 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -150.27 17.91 0.84 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.615 0.766 . . . . 0.0 110.882 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 15.1 tpt -54.13 -35.06 61.79 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.18 -37.19 94.11 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.97 -15.6 58.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 122.36 -0.494 . . . . 0.0 111.254 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.3 -58.11 3.84 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.629 HD23 ' H ' ' B' ' 32' ' ' LEU . 1.9 pt? -81.51 -13.25 58.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 119.875 -0.73 . . . . 0.0 111.489 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -69.5 -35.6 75.69 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 118.582 0.628 . . . . 0.0 109.408 169.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 36.4 t -66.54 -35.41 80.16 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.7 -31.76 72.94 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.765 0.317 . . . . 0.0 110.923 175.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -87.39 -20.86 26.09 Favored 'General case' 0 N--CA 1.455 -0.193 0 O-C-N 121.759 -0.588 . . . . 0.0 111.059 178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -69.51 -36.03 76.09 Favored 'General case' 0 CA--C 1.526 0.027 0 CA-C-N 118.447 0.567 . . . . 0.0 111.131 -178.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -67.03 -16.69 64.52 Favored 'General case' 0 N--CA 1.461 0.092 0 CA-C-N 118.057 0.389 . . . . 0.0 111.115 178.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 40.9 m -79.16 -13.31 59.8 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 110.56 -0.163 . . . . 0.0 110.56 173.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.424 ' C ' ' H ' ' B' ' 42' ' ' GLU . 30.8 mm -102.46 -18.45 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 118.213 0.461 . . . . 0.0 111.052 -178.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -74.88 28.92 0.09 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.596 0.758 . . . . 0.0 110.663 175.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' B' ' 40' ' ' ILE . 80.6 mm-40 -137.67 177.62 7.73 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.084 0.954 . . . . 0.0 110.794 -174.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -65.82 179.33 0.88 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.889 0.876 . . . . 0.0 111.489 177.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.42 151.52 74.89 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 123.074 0.55 . . . . 0.0 110.173 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -79.07 79.15 3.47 Favored 'Trans proline' 0 N--CA 1.454 -0.823 0 C-N-CA 124.091 3.194 . . . . 0.0 110.869 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.43 -3.77 0.49 Allowed 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 26.6 pt-20 -61.25 -23.77 65.89 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.766 -0.584 . . . . 0.0 112.179 179.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -69.26 -33.63 73.54 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 118.268 0.485 . . . . 0.0 110.211 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 78.7 mt -83.51 -13.03 55.51 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.89 -0.506 . . . . 0.0 110.561 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -71.12 -23.47 62.1 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.58 -17.89 61.13 Favored 'General case' 0 CA--C 1.523 -0.072 0 C-N-CA 122.741 0.417 . . . . 0.0 110.804 174.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.439 ' C ' ' H ' ' B' ' 54' ' ' LYS . 37.2 mt -90.59 -14.76 31.85 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 122.317 -0.24 . . . . 0.0 110.889 173.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -72.35 18.54 0.09 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.062 0.945 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.6 pttt -137.14 6.11 2.82 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.472 1.109 . . . . 0.0 110.978 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -149.31 -18.5 0.28 Allowed 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.25 -8.65 56.73 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.314 0.506 . . . . 0.0 112.02 178.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 1.4 mm? 54.01 176.38 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.309 1.444 . . . . 0.0 113.447 -176.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -158.4 175.45 13.7 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.529 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.444 HD23 ' H ' ' B' ' 59' ' ' LEU . 2.0 pt? -148.08 163.81 35.77 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.734 0.813 . . . . 0.0 110.424 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.8 p -155.24 142.75 13.95 Favored Pre-proline 0 CA--C 1.533 0.309 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -178.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.21 177.47 7.19 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 123.285 2.656 . . . . 0.0 110.902 175.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 . . . . . 0 CA--C 1.533 0.305 0 C-N-CA 124.72 1.208 . . . . 0.0 111.665 -179.02 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.3 mtp . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p -144.98 12.2 1.41 Allowed 'General case' 0 C--N 1.339 0.115 0 C-N-CA 122.689 0.396 . . . . 0.0 111.587 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 49.0 tp -54.92 -33.68 62.41 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 122.909 0.484 . . . . 0.0 111.755 -178.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.49 -23.92 65.31 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.79 -0.569 . . . . 0.0 112.007 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -81.0 -0.4 39.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 117.427 0.613 . . . . 0.0 111.177 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -134.37 3.56 3.36 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.403 0.681 . . . . 0.0 110.432 -178.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.403 HD13 ' O ' ' A' ' 7' ' ' LEU . 0.8 OUTLIER -106.06 -41.65 5.31 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.873 0.869 . . . . 0.0 108.952 178.05 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.434 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -60.84 -43.5 91.85 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -177.219 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 74.3 Cg_endo -72.69 -4.46 15.38 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.386 2.057 . . . . 0.0 113.284 -173.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -135.56 12.77 3.47 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.236 0.471 . . . . 0.0 110.801 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -56.03 -41.05 89.02 Favored Pre-proline 0 CA--C 1.537 0.474 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -179.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -81.49 -8.28 12.62 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 121.954 1.77 . . . . 0.0 112.466 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.92 -21.42 65.99 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-N 118.855 0.752 . . . . 0.0 110.834 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 63.4 mt -73.09 -18.98 61.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 117.795 0.27 . . . . 0.0 110.487 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.9 mtt-85 -97.93 -19.75 17.88 Favored 'General case' 0 C--N 1.339 0.13 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -53.6 -27.24 25.59 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.88 1.272 . . . . 0.0 111.833 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 12.8 p90 -140.44 -14.86 0.97 Allowed 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.681 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.5 -29.73 75.93 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 111.632 -0.587 . . . . 0.0 111.632 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -70.77 -3.68 20.01 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.23 1.015 . . . . 0.0 112.037 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -126.32 6.36 7.03 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.631 0.772 . . . . 0.0 110.398 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.4 tp -107.96 6.63 27.37 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.293 1.037 . . . . 0.0 110.103 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 62.8 p -132.87 -19.28 2.31 Favored 'General case' 0 C--O 1.23 0.047 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -175.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.28 -2.84 87.39 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-O 119.672 -0.515 . . . . 0.0 112.712 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 43.6 t -157.92 139.26 13.54 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 118.214 1.007 . . . . 0.0 110.858 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -65.23 -20.1 66.27 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 122.42 -0.175 . . . . 0.0 111.184 178.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -72.99 -34.56 66.49 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 178.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -83.18 -29.02 28.91 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.226 -0.286 . . . . 0.0 110.226 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.52 -40.98 67.05 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 178.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.67 -33.67 69.04 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 117.434 0.617 . . . . 0.0 110.684 177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -69.72 -45.92 67.11 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 119.469 -0.301 . . . . 0.0 111.448 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -67.65 -32.58 73.36 Favored 'General case' 0 C--O 1.227 -0.129 0 CA-C-N 118.453 0.57 . . . . 0.0 111.248 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.6 t -63.94 -50.15 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.14 0 CA-C-N 118.173 0.442 . . . . 0.0 110.673 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -75.74 -27.38 58.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.974 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.8 -23.03 59.63 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.741 -0.171 . . . . 0.0 110.828 176.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.0 m -63.57 -48.0 79.21 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -70.58 -35.26 72.95 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.73 0.3 . . . . 0.0 110.333 -178.157 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -67.12 -16.66 64.46 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 121.876 -0.515 . . . . 0.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -87.39 -6.88 58.27 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 121.956 -0.465 . . . . 0.0 111.281 174.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 36.2 mm -98.36 -27.59 3.68 Favored 'Isoleucine or valine' 0 C--N 1.339 0.122 0 CA-C-N 117.856 0.298 . . . . 0.0 110.682 -179.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.0 m -66.69 -7.09 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -89.81 -15.83 31.48 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 118.077 0.399 . . . . 0.0 110.559 175.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -170.04 89.67 0.53 Allowed Pre-proline 0 CA--C 1.532 0.273 0 C-N-CA 124.199 1.0 . . . . 0.0 109.2 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.48 -5.97 15.35 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 123.029 2.486 . . . . 0.0 112.219 -177.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.6 -14.51 59.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.497 0.319 . . . . 0.0 110.623 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -83.87 9.35 12.29 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.273 0.629 . . . . 0.0 111.352 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -130.54 79.97 71.13 Favored Pre-proline 0 N--CA 1.451 -0.412 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.43 157.59 61.17 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.303 2.669 . . . . 0.0 111.408 -173.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.66 7.46 2.77 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.256 1.022 . . . . 0.0 110.493 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.7 9.49 1.8 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.623 1.169 . . . . 0.0 110.835 174.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.2 m -131.77 -172.43 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 C-N-CA 124.509 1.123 . . . . 0.0 109.272 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -58.43 148.98 62.55 Favored Pre-proline 0 N--CA 1.455 -0.216 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.26 13.19 0.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 124.169 3.246 . . . . 0.0 112.372 -177.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -129.11 -16.95 3.95 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 119.312 -0.375 . . . . 0.0 111.371 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' A' ' 54' ' ' LEU . 18.4 mt -71.56 -39.03 70.91 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 118.649 0.659 . . . . 0.0 110.479 179.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -66.2 -39.02 94.34 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 177.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -59.92 -54.3 47.77 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.541 0.736 . . . . 0.0 110.147 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -72.3 -36.29 68.89 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 119.401 -0.333 . . . . 0.0 111.81 -175.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 52.9 tpt85 -60.77 -41.84 96.31 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.617 0.644 . . . . 0.0 111.394 -174.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.8 mmm -81.38 -26.8 35.19 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.521 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -68.17 -38.0 81.59 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 118.686 0.676 . . . . 0.0 110.323 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -67.75 -24.79 65.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 122.47 0.308 . . . . 0.0 110.242 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -70.22 -37.89 71.81 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 111.821 -0.512 . . . . 0.0 111.821 179.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 50.6 mm -72.25 -40.04 64.97 Favored 'Isoleucine or valine' 0 C--N 1.339 0.136 0 CA-C-N 117.985 0.892 . . . . 0.0 109.999 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -69.14 -35.58 76.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 122.555 -0.091 . . . . 0.0 110.825 -178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.86 -27.69 65.05 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 122.387 -0.196 . . . . 0.0 110.689 177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.1 t -82.72 -18.14 41.85 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.286 0.234 . . . . 0.0 110.703 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -46.75 30.04 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.327 0.251 . . . . 0.0 110.823 -179.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -77.41 -15.89 59.11 Favored 'General case' 0 CA--C 1.527 0.09 0 O-C-N 122.276 -0.265 . . . . 0.0 111.211 179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.71 2.03 24.26 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.412 0.685 . . . . 0.0 111.237 176.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -137.75 0.9 2.27 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.089 0.556 . . . . 0.0 111.362 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 87.41 5.94 78.48 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-O 119.728 -0.484 . . . . 0.0 113.327 175.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.65 -15.41 63.51 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.155 0.978 . . . . 0.0 111.405 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -160.11 153.77 22.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.726 0.81 . . . . 0.0 109.75 177.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -146.33 -9.4 0.5 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.699 0.4 . . . . 0.0 112.046 177.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 t -165.84 176.85 7.58 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.397 0.679 . . . . 0.0 109.681 -178.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.4 p -152.65 155.91 38.22 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 122.772 0.429 . . . . 0.0 110.464 177.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -157.26 162.28 39.2 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.8 m -139.0 165.54 26.86 Favored 'General case' 0 C--O 1.23 0.055 0 O-C-N 122.084 -0.385 . . . . 0.0 110.79 -177.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -149.34 25.92 0.87 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.879 0.472 . . . . 0.0 110.994 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.07 164.88 1.47 Allowed 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.983 0.42 . . . . 0.0 111.307 178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -64.97 -10.65 30.95 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -174.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 157.04 21.74 0.03 OUTLIER Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.255 -0.747 . . . . 0.0 113.437 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.5 t -137.51 6.73 2.77 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.423 1.111 . . . . 0.0 112.955 -175.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -143.03 -35.89 0.39 Allowed 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.709 0.403 . . . . 0.0 110.043 173.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.44 -27.06 67.53 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.8 p -66.56 -27.62 40.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 C-N-CA 122.536 0.334 . . . . 0.0 110.422 178.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.66 -0.45 55.17 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.013 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.2 ppt_? -130.29 -18.52 3.24 Favored 'General case' 0 N--CA 1.457 -0.091 0 CA-C-N 118.149 0.431 . . . . 0.0 112.087 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.1 -1.82 31.09 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.766 0.426 . . . . 0.0 110.543 174.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.595 ' C ' HD12 ' A' ' 91' ' ' LEU . 99.4 mtt180 -130.24 -13.49 3.94 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.004 0.522 . . . . 0.0 112.317 -177.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.595 HD12 ' C ' ' A' ' 90' ' ' ARG . 9.9 mp -129.68 15.51 5.92 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.481 0.713 . . . . 0.0 111.611 -172.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.33 9.51 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 177.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 91' ' ' LEU . 66.9 mtt85 -124.6 15.34 8.8 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.545 0.738 . . . . 0.0 110.892 -176.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 39.3 ttm -115.35 142.38 46.77 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.028 0.931 . . . . 0.0 109.467 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.504 HG23 ' H ' ' A' ' 98' ' ' SER . 5.7 t -68.04 140.42 93.49 Favored Pre-proline 0 CA--C 1.531 0.22 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -53.2 -22.73 20.63 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.968 3.112 . . . . 0.0 114.418 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -79.3 -46.27 18.04 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 118.425 0.557 . . . . 0.0 110.031 -177.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.504 ' H ' HG23 ' A' ' 95' ' ' THR . 55.6 m -67.81 -23.54 65.2 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.214 -0.304 . . . . 0.0 111.175 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.0 ttp180 -67.73 -33.32 74.63 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 176.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -75.22 -37.49 61.09 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 177.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.72 -33.85 76.94 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 178.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 50.1 tp -61.78 -50.92 70.43 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.577 ' HA ' ' SD ' ' A' ' 107' ' ' MET . 3.8 pp -79.44 0.88 27.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -178.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 115' ' ' ALA . 14.8 tp -97.29 -6.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.231 -0.293 . . . . 0.0 111.391 177.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 70.8 p -140.53 -16.78 0.9 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 177.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -81.53 -12.89 58.66 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.465 1.03 . . . . 0.0 113.045 -177.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.577 ' SD ' ' HA ' ' A' ' 103' ' ' LEU . 1.8 pmm? -154.08 14.9 0.47 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -129.58 -11.99 4.42 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.525 0.602 . . . . 0.0 112.052 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 68.51 7.55 53.57 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-O 118.887 -0.951 . . . . 0.0 114.761 171.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -58.39 150.34 22.52 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.354 1.577 . . . . 0.0 110.634 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 95.9 p -71.8 161.28 79.54 Favored Pre-proline 0 N--CA 1.454 -0.269 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.48 -16.49 47.5 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 122.059 1.84 . . . . 0.0 111.02 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -79.17 -45.05 20.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 117.884 0.311 . . . . 0.0 110.572 178.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -74.07 -32.0 63.08 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.413 ' HA ' HD21 ' A' ' 104' ' ' LEU . . . -69.54 -22.67 63.54 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 122.239 0.216 . . . . 0.0 110.991 177.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.11 -29.79 34.75 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.516 0.198 . . . . 0.0 110.694 179.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.3 -38.94 82.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.663 0.385 . . . . 0.0 111.333 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 57.0 mt -72.91 -4.06 29.61 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 12.5 pt -135.41 11.64 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 118.986 0.812 . . . . 0.0 111.281 177.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 52.03 59.57 4.44 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.905 1.282 . . . . 0.0 113.827 176.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 32.9 m -137.03 -178.42 2.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 C-N-CA 123.521 0.728 . . . . 0.0 109.932 176.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -83.28 160.26 21.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 175.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 86.2 m -60.49 -37.56 81.49 Favored 'General case' 0 C--O 1.232 0.177 0 O-C-N 121.954 -0.466 . . . . 0.0 110.579 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.9 t -70.5 -24.51 62.86 Favored 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 122.364 -0.21 . . . . 0.0 111.029 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 -71.68 -37.53 70.72 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.126 178.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 65.7 t -65.05 -38.63 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-N 118.401 0.546 . . . . 0.0 109.842 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -58.78 -37.86 77.26 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 110.508 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 81.7 m -78.05 -38.4 44.54 Favored 'General case' 0 N--CA 1.457 -0.085 0 O-C-N 122.432 -0.167 . . . . 0.0 110.656 178.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 60.3 mt -64.85 -33.35 75.79 Favored 'General case' 0 N--CA 1.456 -0.139 0 O-C-N 122.082 -0.386 . . . . 0.0 111.672 -177.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.3 m -80.56 -28.68 11.73 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 CA-C-N 118.587 0.631 . . . . 0.0 110.521 177.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 89.5 m -68.58 -38.2 80.5 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 177.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -76.72 -27.62 55.51 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.267 -0.271 . . . . 0.0 110.888 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -68.67 -49.85 55.74 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 122.23 -0.294 . . . . 0.0 110.309 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -71.02 -22.34 62.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 119.716 -0.183 . . . . 0.0 111.131 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -73.91 -37.18 64.73 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.746 0.248 . . . . 0.0 110.726 177.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -74.45 -19.35 60.42 Favored 'General case' 0 N--CA 1.457 -0.079 0 CA-C-N 117.599 0.182 . . . . 0.0 110.544 177.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 19.2 mm -75.11 -56.39 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.79 -16.64 64.21 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -176.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -70.71 -22.29 62.46 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 179.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -157.57 -38.15 0.07 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -173.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 30.3 p 44.89 19.05 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.504 1.121 . . . . 0.0 112.274 -169.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -147.51 148.25 31.0 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 124.351 1.06 . . . . 0.0 109.636 -171.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -163.29 40.72 0.1 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.277 0.631 . . . . 0.0 110.038 179.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -125.2 22.47 7.85 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.893 0.877 . . . . 0.0 111.462 -172.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.69 156.97 46.97 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 122.967 0.507 . . . . 0.0 110.386 178.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.401 ' N ' HD23 ' A' ' 146' ' ' LEU . 2.2 pt? -160.31 169.67 22.67 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 122.575 0.35 . . . . 0.0 111.081 -177.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 10.7 t 41.52 59.26 9.15 Favored Pre-proline 0 CA--C 1.533 0.309 0 C-N-CA 124.728 1.211 . . . . 0.0 112.014 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.52 166.04 28.65 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.383 2.722 . . . . 0.0 110.616 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -153.93 157.59 39.43 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 170.48 -174.79 44.47 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 79.8 p -149.29 21.19 0.95 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.135 0.574 . . . . 0.0 110.642 -178.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 49.8 p-80 -139.7 11.03 2.47 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.414 0.686 . . . . 0.0 111.717 -174.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -142.28 12.23 1.96 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.915 0.486 . . . . 0.0 112.102 -179.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 55.8 t60 45.18 40.64 5.1 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.593 1.157 . . . . 0.0 113.115 175.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -55.72 163.4 1.39 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.766 0.427 . . . . 0.0 111.822 177.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -153.05 165.57 35.17 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 123.221 0.609 . . . . 0.0 109.518 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 28.8 p80 . . . . . 0 C--O 1.252 1.222 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.622 -179.332 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 110.27 -0.27 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 72.9 mt 52.76 22.98 2.51 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.148 0.979 . . . . 0.0 112.811 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -70.86 4.52 2.51 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.848 0.859 . . . . 0.0 111.969 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.467 HD13 ' H ' ' B' ' 4' ' ' LEU . 0.0 OUTLIER -145.23 156.23 54.23 Favored Pre-proline 0 CA--C 1.533 0.292 0 C-N-CA 123.615 0.766 . . . . 0.0 109.888 -176.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.52 153.1 49.5 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.324 2.683 . . . . 0.0 111.254 -177.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 169.29 14.89 0.02 OUTLIER Glycine 0 CA--C 1.524 0.623 0 CA-C-O 119.625 -0.541 . . . . 0.0 112.969 -178.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 33.4 p30 -148.6 176.07 10.65 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 118.102 0.951 . . . . 0.0 111.85 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -67.09 9.45 0.2 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.558 1.143 . . . . 0.0 113.715 -176.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -130.99 0.8 4.25 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.53 0.605 . . . . 0.0 111.633 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -140.98 3.77 1.83 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.196 0.599 . . . . 0.0 111.317 176.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -141.67 6.87 1.87 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.871 0.869 . . . . 0.0 110.363 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.0 -177.42 6.52 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.252 1.021 . . . . 0.0 109.275 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 50.5 m -133.87 -0.71 3.09 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 25.3 t -162.05 162.87 28.95 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.994 0.426 . . . . 0.0 110.488 177.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -152.93 7.17 0.4 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.374 1.07 . . . . 0.0 110.556 176.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -71.02 169.63 14.54 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.808 0.843 . . . . 0.0 111.295 -176.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 56.4 p -154.92 52.1 0.69 Allowed Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 123.183 0.593 . . . . 0.0 111.403 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -70.11 -0.17 6.8 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 123.551 2.834 . . . . 0.0 112.633 -177.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . 53.73 -166.93 0.07 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.144 0.978 . . . . 0.0 112.468 -178.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -145.88 147.16 31.49 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 2.2 t -144.15 5.41 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -169.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.11 17.11 2.27 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 -173.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 27.5 m -64.88 -0.24 1.44 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.908 0.483 . . . . 0.0 112.21 176.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -141.5 15.7 2.18 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.977 0.911 . . . . 0.0 111.097 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -73.1 10.45 0.94 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.793 0.837 . . . . 0.0 111.672 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -140.95 160.7 39.52 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.784 0.834 . . . . 0.0 110.338 -178.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -66.22 -12.2 54.67 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.424 0.69 . . . . 0.0 112.58 -175.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.4 tpt -60.83 -27.0 67.75 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.302 0.501 . . . . 0.0 111.492 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.35 -33.69 61.32 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.669 -0.973 . . . . 0.0 110.669 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.49 -23.02 37.63 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 117.163 0.482 . . . . 0.0 110.841 179.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.05 -43.02 72.09 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 178.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.422 ' HB2' ' HE2' ' A' ' 107' ' ' MET . 85.2 mt -70.25 -39.34 75.05 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.112 177.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -67.93 -35.29 78.19 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.053 -177.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 43.1 t -65.81 -42.94 90.05 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.477 0.581 . . . . 0.0 110.214 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.26 -23.9 66.49 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 122.592 0.357 . . . . 0.0 111.81 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -110.77 -14.89 13.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 62.0 tp60 -68.33 -38.19 81.29 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -64.74 -24.99 67.74 Favored 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 111.211 0.078 . . . . 0.0 111.211 176.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 39.8 m -72.04 -12.59 61.29 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 47.0 pt -129.1 8.36 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 118.403 0.547 . . . . 0.0 111.92 -178.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.56 24.72 0.56 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.26 0.624 . . . . 0.0 111.536 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -144.77 -178.32 5.96 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.859 -0.526 . . . . 0.0 111.622 -176.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -61.91 175.96 0.61 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.583 1.153 . . . . 0.0 111.808 -178.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.2 m -135.33 155.88 78.36 Favored Pre-proline 0 C--O 1.232 0.156 0 C-N-CA 122.924 0.49 . . . . 0.0 111.064 -174.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.2 176.24 2.12 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.844 3.03 . . . . 0.0 112.472 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -148.55 -2.39 0.5 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.389 173.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -65.29 -24.85 67.41 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.681 0.393 . . . . 0.0 111.483 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 45.2 mtm -76.18 -36.7 58.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.403 0.281 . . . . 0.0 110.956 -179.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 64.2 mt -77.72 -15.58 59.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.616 -0.678 . . . . 0.0 109.736 175.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -71.11 -21.33 62.23 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.829 -0.545 . . . . 0.0 109.698 173.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 52.0 mt -71.56 -14.61 62.14 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 173.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' B' ' 54' ' ' LYS . 28.5 mt -89.73 -16.47 30.27 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 117.747 0.249 . . . . 0.0 111.48 174.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -71.09 18.35 0.06 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.415 ' H ' ' C ' ' B' ' 52' ' ' LEU . 61.8 pttt -133.91 2.7 3.41 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.31 0.644 . . . . 0.0 111.918 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -153.04 -3.3 0.22 Allowed 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -132.84 0.26 3.51 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 118.751 0.705 . . . . 0.0 112.096 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 49.9 tp -77.6 153.34 33.34 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -144.67 169.37 18.12 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 123.364 0.666 . . . . 0.0 110.184 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.4 tp -67.27 -11.72 58.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.061 0.544 . . . . 0.0 111.677 -178.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 13.1 p -150.43 139.39 13.03 Favored Pre-proline 0 CA--C 1.532 0.254 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -73.47 178.31 6.84 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 123.666 2.911 . . . . 0.0 111.194 177.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 . . . . . 0 C--N 1.337 0.06 0 C-N-CA 123.245 0.618 . . . . 0.0 109.888 179.802 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.0 ttm . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 110.63 -0.137 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.2 p -145.52 -11.89 0.52 Allowed 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 122.798 0.439 . . . . 0.0 111.7 176.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 48.1 tp -85.27 -31.73 22.94 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 117.997 0.362 . . . . 0.0 111.04 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -67.83 -30.62 74.54 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -73.11 2.18 7.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.903 0.881 . . . . 0.0 111.269 177.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -130.66 -20.37 2.9 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 123.461 0.704 . . . . 0.0 111.043 -179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 tp -88.53 -32.51 18.15 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.568 0.347 . . . . 0.0 111.313 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.447 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -59.79 -44.28 96.83 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -174.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 72.2 Cg_endo -71.89 -2.32 11.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.098 1.866 . . . . 0.0 112.423 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -135.2 12.73 3.56 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.122 0.569 . . . . 0.0 110.844 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.415 ' N ' ' HD2' ' A' ' 12' ' ' PRO . 43.0 tp -57.82 -41.94 92.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.835 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 11' ' ' LEU . 88.3 Cg_endo -76.67 -10.94 18.61 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.592 1.528 . . . . 0.0 112.275 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -70.78 -21.28 62.52 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-N 118.775 0.716 . . . . 0.0 110.814 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.4 mt -70.79 -28.18 64.46 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.831 0.287 . . . . 0.0 110.984 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 ptm85 -105.04 -13.67 15.67 Favored 'General case' 0 N--CA 1.458 -0.039 0 O-C-N 122.243 -0.286 . . . . 0.0 110.728 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -52.68 -25.81 12.02 Favored 'General case' 0 C--N 1.338 0.071 0 C-N-CA 123.911 0.884 . . . . 0.0 110.845 175.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -139.99 -10.1 1.15 Allowed 'General case' 0 N--CA 1.455 -0.223 0 O-C-N 123.102 0.251 . . . . 0.0 111.576 175.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.0 -28.47 63.73 Favored Glycine 0 C--N 1.34 0.76 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 173.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -68.34 -8.4 39.61 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.199 0.6 . . . . 0.0 111.837 175.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -116.73 0.37 12.56 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.103 0.561 . . . . 0.0 111.622 -176.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -97.61 -3.53 39.36 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.062 0.545 . . . . 0.0 111.379 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.9 t -156.59 -5.65 0.11 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 56.58 26.06 51.77 Favored Glycine 0 CA--C 1.531 1.035 0 O-C-N 121.891 -0.506 . . . . 0.0 113.778 174.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 t -150.92 127.45 10.77 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 117.798 0.799 . . . . 0.0 109.553 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -71.82 -18.66 62.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 119.515 -0.278 . . . . 0.0 111.112 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -68.32 -42.67 79.04 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -81.17 -31.72 33.92 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 177.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.52 -42.54 93.57 Favored Glycine 0 C--N 1.335 0.515 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -72.51 -30.23 64.3 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 117.595 0.697 . . . . 0.0 110.148 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -71.09 -41.82 70.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 119.411 -0.328 . . . . 0.0 111.487 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -66.07 -44.21 85.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 118.412 0.551 . . . . 0.0 111.598 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.7 m -68.52 -34.72 66.96 Favored 'Isoleucine or valine' 0 C--O 1.23 0.067 0 CA-C-N 118.499 0.59 . . . . 0.0 110.97 -176.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 47.9 ttp180 -79.45 -32.45 42.68 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 122.094 -0.379 . . . . 0.0 110.825 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.61 63.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 175.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 64.5 m -64.61 -40.38 95.39 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.483 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.4 OUTLIER -77.62 -34.98 53.16 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.73 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -61.67 -24.27 66.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.96 -0.462 . . . . 0.0 110.411 179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.15 -16.17 59.24 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.593 0.357 . . . . 0.0 111.04 175.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 20.3 mm -90.57 -18.92 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 58.7 t -64.52 -4.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.277 0.631 . . . . 0.0 110.968 176.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.47 1.68 9.57 Favored 'General case' 0 C--N 1.34 0.177 0 O-C-N 121.697 -0.627 . . . . 0.0 111.195 178.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -158.16 54.35 0.74 Allowed Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 123.239 0.616 . . . . 0.0 111.094 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -72.08 -3.71 13.79 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 123.981 3.121 . . . . 0.0 112.034 -176.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -106.01 12.59 30.3 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.268 0.627 . . . . 0.0 112.131 -175.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -138.67 7.92 2.56 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -56.15 132.13 74.88 Favored Pre-proline 0 CA--C 1.531 0.237 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -69.97 120.94 7.6 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 123.346 2.697 . . . . 0.0 112.038 -173.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.4 mmm180 -142.14 6.17 1.73 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.96 1.304 . . . . 0.0 110.205 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -82.53 13.3 3.77 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.117 0.967 . . . . 0.0 111.068 178.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.65 -166.73 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 C-N-CA 125.03 1.332 . . . . 0.0 108.654 -177.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.54 144.09 18.35 Favored Pre-proline 0 N--CA 1.455 -0.195 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -65.87 2.02 1.96 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.899 2.399 . . . . 0.0 112.259 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -121.64 -18.35 7.19 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 123.616 0.766 . . . . 0.0 111.162 176.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -74.34 -31.21 62.34 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 118.262 0.483 . . . . 0.0 110.325 -178.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -70.46 -33.99 68.05 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.74 -44.54 95.93 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -80.5 -19.87 44.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 119.315 -0.374 . . . . 0.0 111.782 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 24.3 tpt180 -70.48 -47.31 61.17 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 118.643 0.656 . . . . 0.0 110.548 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 87.9 mmm -71.34 -33.7 69.84 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.098 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -66.72 -39.85 88.16 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 122.288 -0.258 . . . . 0.0 111.314 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -68.41 -24.72 64.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 178.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.75 -37.57 84.48 Favored Glycine 0 C--N 1.339 0.717 0 N-CA-C 111.394 -0.683 . . . . 0.0 111.394 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 51.2 mm -73.48 -41.6 56.34 Favored 'Isoleucine or valine' 0 C--N 1.339 0.127 0 CA-C-N 117.84 0.82 . . . . 0.0 110.166 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.4 t90 -67.54 -38.17 83.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.713 0.233 . . . . 0.0 110.934 -176.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.05 -29.0 62.65 Favored 'General case' 0 N--CA 1.456 -0.15 0 O-C-N 122.241 -0.287 . . . . 0.0 111.108 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 40.2 t -80.08 -30.68 39.27 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 117.539 0.154 . . . . 0.0 110.938 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.77 -31.0 59.33 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.411 -0.181 . . . . 0.0 111.182 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -85.33 -12.45 52.23 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 122.172 -0.33 . . . . 0.0 111.335 178.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.23 0.03 26.74 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -140.34 4.51 2.01 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 122.665 0.386 . . . . 0.0 111.362 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.13 6.21 88.33 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 119.941 -0.366 . . . . 0.0 112.809 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -75.59 5.14 6.41 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 117.664 0.732 . . . . 0.0 111.807 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -150.78 172.2 15.98 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 121.077 0.465 . . . . 0.0 111.131 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -146.66 -167.13 2.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.06 1.344 . . . . 0.0 108.729 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 10.4 t -138.9 164.17 30.37 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.993 0.517 . . . . 0.0 110.03 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 23.0 t -158.43 -172.72 3.97 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.398 0.679 . . . . 0.0 109.774 -176.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -148.58 8.55 0.79 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.5 m -146.14 142.13 28.18 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-N 118.896 0.771 . . . . 0.0 111.499 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -154.13 10.91 0.4 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.313 1.045 . . . . 0.0 110.403 175.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -153.81 -174.89 5.13 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.622 0.769 . . . . 0.0 109.582 -176.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -126.17 11.25 7.56 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.106 0.562 . . . . 0.0 110.764 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -166.18 9.71 0.06 OUTLIER Glycine 0 CA--C 1.527 0.843 0 CA-C-O 119.23 -0.761 . . . . 0.0 112.653 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.2 p -139.68 -7.58 1.27 Allowed 'General case' 0 C--N 1.339 0.144 0 CA-C-N 118.567 1.184 . . . . 0.0 112.917 -179.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -137.93 -39.18 0.56 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.75 -25.41 67.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.9 p -66.66 -31.02 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 C-N-CA 122.542 0.337 . . . . 0.0 110.565 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -83.2 -1.08 52.13 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.223 0.609 . . . . 0.0 111.568 -176.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -130.55 -15.07 3.61 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 122.49 0.316 . . . . 0.0 111.698 177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.92 -1.93 18.84 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.871 0.468 . . . . 0.0 110.468 174.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.556 ' C ' HD22 ' A' ' 91' ' ' LEU . 90.8 mtt-85 -129.25 -15.64 4.11 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.994 0.518 . . . . 0.0 111.536 178.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.556 HD22 ' C ' ' A' ' 90' ' ' ARG . 3.5 mm? -138.02 36.44 2.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.114 0.966 . . . . 0.0 110.59 -172.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.88 7.77 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 82.3 mmt-85 -130.68 4.35 4.59 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.062 0.846 . . . . 0.0 112.361 -177.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 57.2 ttm -65.79 143.69 57.34 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 118.369 0.531 . . . . 0.0 111.168 -178.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.8 m -61.37 139.12 94.82 Favored Pre-proline 0 CA--C 1.53 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.926 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -66.62 5.45 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 124.246 3.297 . . . . 0.0 113.564 -177.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.97 -35.03 2.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 49.5 m -62.42 -19.65 63.69 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 122.0 -0.437 . . . . 0.0 109.86 171.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 27.7 mmm-85 -58.26 -41.34 84.06 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 123.664 0.786 . . . . 0.0 110.72 174.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -77.47 -38.49 49.17 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -178.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.73 74.43 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 122.243 -0.286 . . . . 0.0 110.825 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -66.56 -48.65 68.97 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.3 mt -67.93 -14.95 63.37 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 119.392 -0.337 . . . . 0.0 111.882 -179.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.0 mt -98.72 -4.82 32.73 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 122.911 0.484 . . . . 0.0 111.909 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 75.6 p -136.27 10.24 3.24 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -138.99 4.94 2.31 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 2.9 mtm -140.8 -5.02 1.18 Allowed 'General case' 0 C--N 1.339 0.109 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -150.25 -5.88 0.32 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.382 0.992 . . . . 0.0 112.987 179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 61.95 25.25 65.77 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-O 119.009 -0.884 . . . . 0.0 113.828 175.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -55.38 150.16 11.99 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.641 1.22 . . . . 0.0 110.08 177.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 69.7 m -68.39 153.26 95.86 Favored Pre-proline 0 CA--C 1.529 0.172 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.78 -28.62 39.09 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 123.188 2.592 . . . . 0.0 112.807 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -72.84 -32.82 65.74 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 122.23 -0.293 . . . . 0.0 110.772 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -83.52 -36.01 24.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 122.367 -0.208 . . . . 0.0 110.499 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -65.33 -30.02 70.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 122.396 -0.19 . . . . 0.0 110.99 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.55 -28.58 33.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.66 0.384 . . . . 0.0 111.252 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -71.34 -27.62 63.5 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.651 0.78 . . . . 0.0 111.59 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.9 mt -85.78 -0.16 54.53 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.438 HG13 HG22 ' A' ' 121' ' ' VAL . 20.0 pt -135.42 9.86 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 118.509 0.595 . . . . 0.0 111.575 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 55.34 53.92 9.31 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.498 1.119 . . . . 0.0 113.87 175.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.438 HG22 HG13 ' A' ' 119' ' ' ILE . 23.3 m -134.79 174.94 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 C-N-CA 122.895 0.478 . . . . 0.0 110.023 174.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -76.29 158.37 31.6 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 177.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 37.2 m -59.87 -36.61 77.28 Favored 'General case' 0 C--N 1.334 -0.098 0 O-C-N 122.109 -0.37 . . . . 0.0 111.149 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 93.4 p -76.88 -20.92 55.7 Favored 'General case' 0 C--O 1.233 0.186 0 O-C-N 121.79 -0.569 . . . . 0.0 111.1 -178.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.0 -44.02 55.99 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.059 178.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.07 -31.23 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.238 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -62.4 -35.32 78.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.707 0.23 . . . . 0.0 110.408 175.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 86.6 m -75.63 -36.65 60.16 Favored 'General case' 0 N--CA 1.457 -0.097 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 178.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 8.1 mp -67.37 -36.58 81.65 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 119.263 -0.399 . . . . 0.0 111.191 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 34.9 m -76.47 -26.09 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.128 0 CA-C-N 118.937 0.789 . . . . 0.0 110.89 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 82.5 m -66.59 -35.79 81.06 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -80.85 -26.77 36.74 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 122.364 -0.21 . . . . 0.0 110.623 177.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -70.79 -39.53 73.1 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 122.43 -0.169 . . . . 0.0 110.63 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.6 pp -78.18 -22.33 48.78 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.916 -0.49 . . . . 0.0 110.333 177.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.82 -38.71 70.16 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 122.214 -0.304 . . . . 0.0 110.466 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -78.85 -18.83 53.34 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.349 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 5.6 mm -63.68 -51.16 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 172.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -73.12 -17.04 61.44 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -71.89 -17.67 62.1 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -178.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -149.82 -41.98 0.14 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -173.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.0 p 45.81 -7.49 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 117.367 2.358 . . . . 0.0 117.367 -175.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.08 2.73 0.08 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 120.14 1.337 . . . . 0.0 114.386 -177.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -71.99 155.5 40.27 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 118.774 0.715 . . . . 0.0 110.671 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.56 6.55 0.47 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.814 0.446 . . . . 0.0 111.766 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -147.61 17.32 1.15 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.739 0.415 . . . . 0.0 110.192 -177.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 48.9 tp -59.23 154.4 16.41 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.692 0.797 . . . . 0.0 111.251 -178.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.467 HG12 ' H ' ' A' ' 149' ' ' ARG . 45.9 t -142.84 136.03 13.99 Favored Pre-proline 0 N--CA 1.455 -0.176 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.52 0.15 7.33 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.861 3.041 . . . . 0.0 113.236 -177.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . 0.467 ' H ' HG12 ' A' ' 147' ' ' VAL . 61.9 ttt-85 45.69 35.09 1.99 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.462 1.105 . . . . 0.0 111.851 -177.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -77.16 3.52 57.72 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 123.534 0.588 . . . . 0.0 112.367 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 82.5 p -150.72 171.3 17.38 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.699 0.75 . . . . 0.0 110.48 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -152.62 168.54 25.28 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 123.391 0.677 . . . . 0.0 109.691 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -143.19 8.83 1.64 Allowed 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.921 0.488 . . . . 0.0 111.369 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 53.7 m80 56.52 6.8 0.3 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.915 1.286 . . . . 0.0 113.253 -177.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -159.53 148.57 18.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.716 0.806 . . . . 0.0 109.205 177.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -150.99 168.09 25.62 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.553 0.741 . . . . 0.0 109.83 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 44.9 p-80 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.082 -1.437 . . . . 0.0 110.565 -179.011 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 120.659 0.266 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 42.0 tp -151.05 158.41 44.05 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -70.13 -9.62 56.18 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 66.7 mt -147.95 159.11 41.11 Favored Pre-proline 0 C--O 1.233 0.218 0 C-N-CA 124.093 0.957 . . . . 0.0 109.294 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.22 163.37 3.45 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 123.915 3.077 . . . . 0.0 112.547 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . -179.98 171.17 42.57 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 178.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 45.9 t30 54.97 179.8 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.598 1.159 . . . . 0.0 111.817 -176.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 64.0 mttp 46.92 32.61 1.9 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.086 0.954 . . . . 0.0 112.571 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -140.8 16.69 2.32 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.02 0.528 . . . . 0.0 110.836 -177.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -60.22 -11.33 6.03 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.127 0.571 . . . . 0.0 112.539 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -66.49 -20.28 66.0 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.333 0.653 . . . . 0.0 111.051 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . 52.82 -173.77 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.67 1.188 . . . . 0.0 112.809 -176.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 79.4 p -148.03 5.95 0.77 Allowed 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 122.613 0.365 . . . . 0.0 111.836 -179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 29.0 m -65.32 163.97 14.45 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.021 0.528 . . . . 0.0 111.272 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -65.37 151.81 45.37 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 122.852 0.461 . . . . 0.0 110.109 178.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -144.37 169.22 18.34 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 123.949 0.9 . . . . 0.0 109.791 -179.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 49.6 m -64.13 161.92 35.97 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.172 0.589 . . . . 0.0 110.967 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -52.17 166.34 0.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.242 3.295 . . . . 0.0 113.118 174.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.24 70.88 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 122.72 0.408 . . . . 0.0 111.402 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.401 ' HD2' ' HA ' ' B' ' 20' ' ' LYS . 20.1 tptm 36.81 55.97 1.18 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 125.439 1.496 . . . . 0.0 112.717 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 33.6 m -60.17 176.38 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 C-N-CA 123.749 0.82 . . . . 0.0 111.903 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -141.11 10.54 2.15 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.519 0.728 . . . . 0.0 111.316 -177.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 48.5 m -145.03 166.27 25.82 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 123.205 0.602 . . . . 0.0 110.135 -177.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -143.17 10.91 1.74 Allowed 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 122.993 0.517 . . . . 0.0 111.482 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -62.86 -8.18 6.49 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 122.941 0.496 . . . . 0.0 111.961 -178.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -67.88 -8.06 33.42 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 123.154 0.581 . . . . 0.0 111.956 178.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -64.01 -9.44 15.97 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 16.3 tpt -62.14 -28.7 69.83 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.108 0.413 . . . . 0.0 110.359 176.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.36 -31.98 62.89 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.87 -17.44 62.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.157 0.479 . . . . 0.0 111.103 178.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.98 -41.69 20.4 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 20.0 mt -70.82 -37.76 73.24 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -66.64 -29.14 69.1 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.357 177.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 38.7 t -67.29 -40.39 86.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.746 0.703 . . . . 0.0 110.277 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.75 -24.23 64.42 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -105.55 -12.49 15.94 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -72.38 -37.99 68.59 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -65.33 -21.86 66.75 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 119.804 -0.141 . . . . 0.0 110.789 177.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 60.8 m -73.89 -13.23 60.88 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 117.628 0.195 . . . . 0.0 111.282 174.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 63.6 mt -98.26 -23.83 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 O-C-N 121.933 -0.479 . . . . 0.0 109.934 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.78 27.2 0.18 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.757 0.823 . . . . 0.0 112.103 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -139.57 175.9 9.18 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.085 0.469 . . . . 0.0 111.207 -178.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -64.68 177.62 0.9 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.193 0.997 . . . . 0.0 112.023 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 26.8 m -136.11 154.28 77.32 Favored Pre-proline 0 C--O 1.233 0.23 0 C-N-CA 123.774 0.829 . . . . 0.0 109.794 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -76.25 -26.59 8.85 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.912 2.408 . . . . 0.0 113.341 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p30 45.15 0.98 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 127.254 2.222 . . . . 0.0 116.599 -177.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.78 -17.06 64.68 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.243 0.929 . . . . 0.0 111.534 -179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 17.9 mtm -68.33 -42.03 79.93 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.87 -16.32 57.22 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -67.71 -21.79 65.29 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.834 -0.541 . . . . 0.0 109.819 173.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.73 -28.86 65.04 Favored 'General case' 0 N--CA 1.457 -0.112 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 173.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.96 -14.33 60.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 121.266 -0.174 . . . . 0.0 111.442 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -67.68 -1.05 4.6 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.123 0.42 . . . . 0.0 110.34 174.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -96.27 -10.15 28.61 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.207 0.603 . . . . 0.0 112.164 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -156.28 -1.1 0.13 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.12 8.74 2.73 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 119.062 0.846 . . . . 0.0 112.74 -178.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.91 169.38 20.69 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 118.238 0.472 . . . . 0.0 110.536 178.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -144.6 179.51 7.24 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.3 1.04 . . . . 0.0 109.645 -178.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -60.64 163.76 5.19 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.271 0.557 . . . . 0.0 111.556 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 12.5 p -58.75 136.38 86.76 Favored Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.515 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -73.33 171.08 18.39 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 123.606 2.871 . . . . 0.0 111.189 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 53.7 ptt85 . . . . . 0 CA--C 1.527 0.083 0 C-N-CA 123.507 0.723 . . . . 0.0 110.78 179.93 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.476 0.843 0 CA-C-O 119.458 -0.306 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 t -157.14 -2.9 0.11 Allowed 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 tp -66.51 -37.49 85.16 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.389 -0.819 . . . . 0.0 110.817 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.19 -28.24 71.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -77.94 1.49 20.49 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.414 0.686 . . . . 0.0 111.443 179.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -130.2 -3.66 4.43 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 123.235 0.614 . . . . 0.0 111.71 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 51.4 mt -111.19 -25.71 9.57 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 119.519 -0.277 . . . . 0.0 111.157 176.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.429 ' N ' ' HD2' ' A' ' 9' ' ' PRO . . . -64.0 -43.96 76.65 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HD2' ' N ' ' A' ' 8' ' ' ALA . 98.5 Cg_endo -74.4 -1.37 10.92 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.52 2.147 . . . . 0.0 113.156 -175.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -134.99 12.26 3.61 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.929 0.492 . . . . 0.0 110.637 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.418 ' N ' ' CD ' ' A' ' 12' ' ' PRO . 43.1 tp -64.47 -39.54 42.36 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 124.847 1.259 . . . . 0.0 114.207 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.418 ' CD ' ' N ' ' A' ' 11' ' ' LEU . 90.6 Cg_endo -77.9 -26.22 6.9 Favored 'Trans proline' 0 N--CA 1.453 -0.901 0 CA-C-N 120.666 1.274 . . . . 0.0 112.436 -172.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -51.52 -38.34 53.69 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.606 0.639 . . . . 0.0 111.981 -173.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.7 mt -67.54 -19.64 65.31 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 -112.56 -32.55 6.43 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.1 mmt85 -73.98 -6.96 50.53 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.268 0.227 . . . . 0.0 111.235 -177.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -136.8 -13.35 1.69 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 122.728 0.411 . . . . 0.0 110.785 167.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -57.45 -33.57 66.61 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -59.86 -24.2 64.04 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 117.931 0.865 . . . . 0.0 111.848 177.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.76 0.94 57.46 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.254 0.622 . . . . 0.0 110.654 178.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.0 tp -120.86 4.83 10.49 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.508 1.123 . . . . 0.0 110.474 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 69.9 p -139.22 -15.04 1.12 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.65 -2.99 87.64 Favored Glycine 0 CA--C 1.526 0.774 0 CA-C-O 119.456 -0.635 . . . . 0.0 113.146 177.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 45.6 t -159.95 136.06 8.71 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.243 1.022 . . . . 0.0 111.099 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -66.2 -19.09 65.73 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 122.37 -0.206 . . . . 0.0 111.344 175.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -75.34 -28.31 59.55 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 117.92 0.327 . . . . 0.0 110.198 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -78.11 -37.25 46.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 175.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.21 -29.99 75.05 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -69.55 -41.74 75.5 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 117.244 0.522 . . . . 0.0 110.887 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.29 -24.03 27.89 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 118.906 -0.569 . . . . 0.0 112.27 -175.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -72.77 -36.34 67.63 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 119.309 0.959 . . . . 0.0 109.925 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.6 t -64.89 -43.17 96.33 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 CA-C-N 117.856 0.298 . . . . 0.0 110.618 177.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -77.31 -28.39 53.22 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 121.279 -0.169 . . . . 0.0 111.266 -178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -75.48 -27.68 58.92 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 122.228 0.211 . . . . 0.0 110.589 175.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 53.0 m -63.95 -39.24 93.69 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.73 -45.9 56.32 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -58.31 -30.25 66.53 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 122.79 0.436 . . . . 0.0 111.773 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.56 0.45 22.96 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 122.794 0.438 . . . . 0.0 111.918 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.411 HD13 ' CD2' ' A' ' 46' ' ' PHE . 73.1 mt -124.72 -13.9 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 C-N-CA 123.909 0.884 . . . . 0.0 110.177 -177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.0 t -61.48 -14.45 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 123.312 0.645 . . . . 0.0 111.09 174.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -122.76 5.6 9.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.582 0.753 . . . . 0.0 110.562 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.83 51.75 0.77 Allowed Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 123.335 0.654 . . . . 0.0 111.51 -175.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -66.46 -8.01 19.5 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 123.176 2.584 . . . . 0.0 111.856 -178.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -82.1 3.37 27.22 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.956 0.902 . . . . 0.0 110.734 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -114.29 9.07 16.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.052 0.541 . . . . 0.0 111.316 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.411 ' CD2' HD13 ' A' ' 39' ' ' ILE . 1.0 OUTLIER -129.59 64.5 71.86 Favored Pre-proline 0 CA--C 1.531 0.248 0 C-N-CA 122.285 0.234 . . . . 0.0 110.489 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.91 170.5 15.4 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.923 3.082 . . . . 0.0 111.334 -178.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.417 ' C ' ' H ' ' A' ' 50' ' ' VAL . 31.1 mmm180 -125.62 12.8 8.04 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.934 0.894 . . . . 0.0 110.589 -177.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -73.35 18.78 0.11 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.47 1.108 . . . . 0.0 111.337 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.417 ' H ' ' C ' ' A' ' 48' ' ' ARG . 27.8 m -136.73 178.6 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.088 0 C-N-CA 124.7 1.2 . . . . 0.0 109.511 -176.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -54.55 149.4 21.32 Favored Pre-proline 0 C--O 1.233 0.209 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -70.3 5.93 1.7 Allowed 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.144 2.562 . . . . 0.0 111.953 -176.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -128.16 -24.06 3.2 Favored 'General case' 0 C--O 1.228 -0.033 0 C-N-CA 123.764 0.825 . . . . 0.0 111.35 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 58.9 tp -66.99 -32.41 73.63 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.333 0.515 . . . . 0.0 110.287 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -72.91 -34.78 58.69 Favored Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.51 -43.22 90.78 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -73.97 -34.5 64.27 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 111.475 0.176 . . . . 0.0 111.475 -177.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 48.3 tpt85 -72.47 -37.43 68.5 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -174.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 95.0 mmm -76.8 -31.98 57.34 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.18 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -67.09 -35.03 78.92 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 174.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -64.46 -31.03 72.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 122.531 0.332 . . . . 0.0 110.236 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -67.02 -43.84 90.0 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 40.6 mm -72.98 -39.07 57.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 117.353 0.577 . . . . 0.0 110.099 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -68.25 -41.65 80.83 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.41 -0.181 . . . . 0.0 111.132 -176.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.91 -32.64 74.03 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 118.186 0.448 . . . . 0.0 110.648 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 35.1 t -70.12 -25.94 63.72 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 117.515 0.143 . . . . 0.0 110.663 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.59 -36.02 17.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 122.493 0.317 . . . . 0.0 111.668 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.5 -15.81 61.79 Favored 'General case' 0 C--O 1.226 -0.14 0 O-C-N 121.973 -0.454 . . . . 0.0 110.522 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.96 7.6 8.64 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 111.471 177.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -130.79 -5.24 4.05 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.45 -9.9 3.49 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 114.747 0.659 . . . . 0.0 114.747 173.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -72.84 6.3 2.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.369 1.084 . . . . 0.0 112.489 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.1 24.0 0.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.516 1.126 . . . . 0.0 112.749 -174.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -154.1 168.61 25.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.253 0.621 . . . . 0.0 110.392 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 14.7 t 43.58 39.83 2.55 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.269 1.427 . . . . 0.0 112.47 -179.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.1 p -132.17 9.52 4.45 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -172.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.44 -14.47 61.26 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 85.8 p -163.72 166.32 22.26 Favored 'General case' 0 C--N 1.339 0.131 0 O-C-N 121.798 -0.564 . . . . 0.0 111.969 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -146.1 23.19 1.36 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.091 0.957 . . . . 0.0 110.547 177.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -142.96 -179.35 6.31 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.109 0.564 . . . . 0.0 110.504 178.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -136.92 14.76 3.09 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.941 0.497 . . . . 0.0 111.51 -176.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -152.44 -0.61 0.23 Allowed Glycine 0 CA--C 1.527 0.832 0 CA-C-O 119.516 -0.602 . . . . 0.0 114.061 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -152.2 8.56 0.48 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.386 1.093 . . . . 0.0 112.198 178.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -139.01 -28.98 0.78 Allowed 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.067 0.547 . . . . 0.0 109.99 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.52 -28.29 67.69 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 174.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 10.5 p -67.03 -28.87 44.3 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-O 120.696 0.284 . . . . 0.0 110.318 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.63 0.74 51.78 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.34 0.656 . . . . 0.0 111.89 -177.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -130.89 -17.83 3.1 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-N 118.121 0.419 . . . . 0.0 111.815 176.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.14 -1.79 24.75 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.586 0.355 . . . . 0.0 110.679 174.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.538 ' O ' HD12 ' A' ' 91' ' ' LEU . 94.7 mtt-85 -128.58 -12.22 4.94 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.621 0.768 . . . . 0.0 111.564 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.538 HD12 ' O ' ' A' ' 90' ' ' ARG . 10.0 mp -131.15 24.11 4.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.5 1.12 . . . . 0.0 109.856 -174.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.0 7.26 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.384 1.474 . . . . 0.0 114.826 -179.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -130.32 -0.15 4.55 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.879 0.763 . . . . 0.0 111.677 -177.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 56.3 ttm -67.09 147.67 52.86 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 122.079 -0.388 . . . . 0.0 110.514 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 96' ' ' PRO . 32.1 m -65.85 140.74 97.36 Favored Pre-proline 0 CA--C 1.531 0.236 0 C-N-CA 123.444 0.698 . . . . 0.0 110.594 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 95' ' ' THR . 65.9 Cg_exo -53.63 2.89 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.474 1 C-N-CA 125.475 4.117 . . . . 0.0 116.313 177.3 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.2 tp -133.18 -20.03 2.17 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 119.056 0.844 . . . . 0.0 111.586 -178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.9 m -70.2 -19.4 63.17 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 122.051 -0.405 . . . . 0.0 110.919 176.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.0 tpp180 -65.47 -45.21 84.59 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 122.437 0.295 . . . . 0.0 110.973 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.401 ' H ' ' HG2' ' A' ' 100' ' ' GLN . 16.3 pt20 -83.26 -25.8 31.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 119.697 -0.192 . . . . 0.0 110.991 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.62 79.42 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.366 0.53 . . . . 0.0 109.785 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.7 tp -67.74 -37.59 82.38 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.994 0.518 . . . . 0.0 109.91 177.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 57.3 tp -66.27 -21.34 66.28 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 122.562 0.345 . . . . 0.0 110.729 177.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.44 HD12 ' HB2' ' A' ' 115' ' ' ALA . 0.2 OUTLIER -90.96 -14.98 30.52 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.207 0.603 . . . . 0.0 111.778 -177.38 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 71.9 p -134.49 4.86 3.42 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -173.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -123.68 -6.98 7.99 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 118.532 0.605 . . . . 0.0 110.771 174.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 21.7 mtm -143.25 0.6 1.18 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -175.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -135.48 -19.96 1.62 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.157 0.435 . . . . 0.0 111.786 -176.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 59.97 17.41 43.8 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 119.118 -0.823 . . . . 0.0 114.501 172.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.415 ' HB2' ' CD1' ' A' ' 104' ' ' LEU . 16.7 m-30 -68.67 162.32 26.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.119 1.46 . . . . 0.0 109.716 178.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 41.4 t -66.1 145.91 99.01 Favored Pre-proline 0 N--CA 1.456 -0.155 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 175.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.27 -20.39 14.76 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 122.893 2.395 . . . . 0.0 112.656 174.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.2 -31.13 65.6 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 122.44 0.296 . . . . 0.0 111.05 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -80.78 -36.31 31.98 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 109.408 -0.589 . . . . 0.0 109.408 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.44 ' HB2' HD12 ' A' ' 104' ' ' LEU . . . -66.23 -32.93 74.65 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.662 0.385 . . . . 0.0 110.517 175.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -72.46 -32.45 66.27 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 122.33 0.252 . . . . 0.0 110.823 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -73.76 -22.9 59.7 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 110.758 176.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 28.2 tp -84.26 -9.95 58.07 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -177.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 14.7 pt -135.25 11.75 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 118.386 0.539 . . . . 0.0 111.351 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 53.52 59.56 4.27 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.65 1.18 . . . . 0.0 113.96 176.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 33.4 m -137.77 -179.83 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 C-N-CA 123.683 0.793 . . . . 0.0 109.67 175.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -79.58 156.31 27.76 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 31.5 m -59.17 -37.27 76.96 Favored 'General case' 0 C--O 1.231 0.131 0 O-C-N 122.141 -0.349 . . . . 0.0 110.77 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 23.3 t -72.58 -24.49 61.11 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.316 0.247 . . . . 0.0 111.38 -177.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -69.45 -39.76 77.58 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.726 -0.609 . . . . 0.0 109.794 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.1 t -64.25 -40.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.107 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -58.73 -37.13 75.51 Favored 'General case' 0 N--CA 1.456 -0.127 0 O-C-N 122.929 0.143 . . . . 0.0 110.618 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 85.9 m -77.86 -38.79 45.28 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.2 mt -64.85 -36.06 83.12 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -177.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 32.2 m -82.86 -28.92 8.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.111 0 CA-C-N 118.343 0.52 . . . . 0.0 111.184 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 54.6 m -68.76 -38.98 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 117.843 0.292 . . . . 0.0 110.224 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -75.79 -27.63 58.05 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.597 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -69.57 -52.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.356 -0.215 . . . . 0.0 110.88 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -71.19 -22.35 62.04 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.19 -38.41 78.63 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 175.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -74.94 -18.65 60.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 119.57 -0.252 . . . . 0.0 110.837 177.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 21.9 mm -74.93 -55.54 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 CA-C-N 118.371 0.532 . . . . 0.0 109.902 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -19.68 65.79 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.071 0.396 . . . . 0.0 111.793 -176.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -70.5 -22.07 62.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.472 ' HG3' ' H ' ' A' ' 142' ' ' ARG . 11.0 pt20 -162.98 -32.32 0.04 OUTLIER 'General case' 0 C--N 1.34 0.192 0 N-CA-C 115.278 1.585 . . . . 0.0 115.278 -170.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' THR . . . . . . . . . . . . . 24.5 p 44.77 25.04 0.12 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.968 0.907 . . . . 0.0 112.163 -170.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.472 ' H ' ' HG3' ' A' ' 140' ' ' GLN . 73.0 mtt85 -149.02 20.13 0.98 Allowed 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.381 1.473 . . . . 0.0 110.317 -171.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.44 143.02 25.16 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.26 1.024 . . . . 0.0 113.169 -171.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -157.02 -6.12 0.1 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.851 176.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -158.22 148.69 20.37 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.146 0.578 . . . . 0.0 109.493 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 46.1 tp -163.27 162.54 25.29 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.973 0.909 . . . . 0.0 108.988 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 24.8 m -136.69 146.96 57.59 Favored Pre-proline 0 CA--C 1.532 0.252 0 C-N-CA 123.025 0.53 . . . . 0.0 110.017 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -80.62 5.66 5.98 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 125.072 3.848 . . . . 0.0 113.408 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -140.48 162.05 36.27 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 118.885 0.766 . . . . 0.0 111.566 -172.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -165.38 -172.1 32.39 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 -179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' SER . . . . . . . . . . . . . 20.1 t -147.94 171.61 15.51 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 117.407 0.603 . . . . 0.0 110.81 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -156.67 159.45 38.42 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.241 0.617 . . . . 0.0 110.114 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' HIS . . . . . . . . . . . . . 54.8 p-80 -156.14 172.67 18.04 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.319 0.647 . . . . 0.0 110.107 178.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 -146.53 -15.08 0.44 Allowed 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -159.8 166.69 29.86 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 122.868 0.467 . . . . 0.0 110.425 178.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -152.68 0.61 0.29 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.098 0.559 . . . . 0.0 111.052 177.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 . . . . . 0 C--O 1.251 1.153 0 C-N-CA 125.055 1.342 . . . . 0.0 111.91 -178.212 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ptp . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 18.4 tp 51.44 32.14 8.28 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.799 0.84 . . . . 0.0 111.459 -177.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -145.5 172.58 13.01 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.67 0.788 . . . . 0.0 110.789 -179.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 18.4 tp -59.56 128.42 86.13 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 122.801 0.441 . . . . 0.0 109.844 -178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -74.5 166.79 28.63 Favored 'Trans proline' 0 N--CA 1.453 -0.881 0 C-N-CA 123.044 2.496 . . . . 0.0 111.197 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 175.23 170.44 38.2 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.546 -1.022 . . . . 0.0 110.546 178.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -159.5 165.63 32.6 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.724 0.41 . . . . 0.0 110.343 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -153.3 154.81 35.32 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.044 0.938 . . . . 0.0 109.18 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -153.66 -179.24 7.62 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.992 0.517 . . . . 0.0 110.779 -176.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -148.19 178.13 8.82 Favored 'General case' 0 CA--C 1.528 0.124 0 C-N-CA 123.633 0.773 . . . . 0.0 109.479 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 13.9 tppt? -140.78 17.15 2.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 122.596 0.358 . . . . 0.0 111.367 -176.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.5 171.18 15.94 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.857 0.36 . . . . 0.0 110.887 -179.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 80.4 p -156.75 173.97 16.18 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.006 0.922 . . . . 0.0 109.98 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 88.0 p -67.1 165.7 15.36 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 122.629 0.372 . . . . 0.0 111.262 178.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -72.74 -2.01 18.69 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.335 0.654 . . . . 0.0 112.113 176.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 52.79 -170.27 0.04 OUTLIER 'General case' 0 C--N 1.343 0.296 0 C-N-CA 124.504 1.122 . . . . 0.0 112.477 -177.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 41.9 m 44.21 54.16 11.57 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.414 1.085 . . . . 0.0 113.391 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.86 166.29 29.44 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.339 2.693 . . . . 0.0 110.563 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -155.6 169.0 25.33 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.607 0.363 . . . . 0.0 111.001 -179.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.9 14.22 0.92 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.903 0.881 . . . . 0.0 111.305 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 32.1 m -141.31 -174.25 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 124.235 1.014 . . . . 0.0 109.886 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.51 171.79 13.85 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.488 0.715 . . . . 0.0 110.691 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 11.2 t -154.77 -170.06 3.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.003 0.521 . . . . 0.0 110.114 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -134.42 174.98 9.94 Favored 'General case' 0 C--O 1.23 0.062 0 C-N-CA 123.93 0.892 . . . . 0.0 109.732 -178.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -61.03 -22.84 64.95 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.987 -178.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 53.1 ptt85 47.0 -33.18 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 130.563 3.545 . . . . 0.0 118.315 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -152.6 -16.41 0.17 Allowed 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 120.053 1.297 . . . . 0.0 111.46 -178.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' MET . . . . . . . . . . . . . 17.2 tpt -66.41 -29.02 69.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 118.384 0.538 . . . . 0.0 111.207 -177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.51 -34.74 79.83 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.89 -21.57 65.14 Favored 'General case' 0 N--CA 1.455 -0.221 0 O-C-N 122.297 -0.531 . . . . 0.0 110.939 179.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.88 -36.29 21.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.92 0.391 . . . . 0.0 110.322 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 39.1 mt -72.99 -45.82 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.869 0.468 . . . . 0.0 110.733 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' ARG . . . . . . . . . . . . . 21.1 tpp85 -73.0 -27.4 61.76 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.002 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 46.8 t -66.52 -36.14 81.96 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.692 0.678 . . . . 0.0 110.311 177.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.26 -30.05 66.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 122.125 0.17 . . . . 0.0 110.965 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -91.29 -25.45 19.44 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 122.045 -0.41 . . . . 0.0 111.686 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -69.19 -37.47 78.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 118.668 0.667 . . . . 0.0 110.988 -178.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -63.22 -20.19 65.21 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 118.213 0.461 . . . . 0.0 110.677 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 9.4 m -86.72 -3.26 59.03 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.652 0.781 . . . . 0.0 111.207 175.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 81.4 mt -119.9 -8.5 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.619 -0.676 . . . . 0.0 111.366 -175.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -70.32 28.38 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.875 0.87 . . . . 0.0 112.122 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -142.1 179.2 7.04 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.571 -0.706 . . . . 0.0 111.371 -178.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -59.53 178.02 0.17 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.428 1.091 . . . . 0.0 113.543 -176.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 34.0 m -133.7 158.47 75.44 Favored Pre-proline 0 C--O 1.234 0.244 0 C-N-CA 124.175 0.99 . . . . 0.0 109.725 -177.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -75.11 -179.82 5.39 Favored 'Trans proline' 0 N--CA 1.451 -1.018 0 C-N-CA 122.818 2.345 . . . . 0.0 110.357 176.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -148.43 -2.34 0.51 Allowed 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 177.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -66.15 -21.69 66.34 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 121.69 -0.631 . . . . 0.0 111.945 -177.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' MET . . . . . . . . . . . . . 2.8 mpp? -67.09 -45.61 76.76 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.455 ' N ' HD22 ' B' ' 49' ' ' LEU . 3.2 mm? -75.98 -20.25 58.04 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -177.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.86 -21.4 66.46 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 122.323 -0.236 . . . . 0.0 110.534 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 64.6 mt -71.09 -26.43 63.05 Favored 'General case' 0 N--CA 1.456 -0.142 0 O-C-N 122.329 -0.232 . . . . 0.0 110.44 173.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.49 ' C ' ' H ' ' B' ' 54' ' ' LYS . 48.6 mt -74.08 -17.28 60.97 Favored 'General case' 0 CA--C 1.522 -0.132 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.954 178.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -69.04 17.94 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.065 0.393 . . . . 0.0 111.324 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.49 ' H ' ' C ' ' B' ' 52' ' ' LEU . 51.9 mtmt -118.47 -2.39 11.06 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.192 0.997 . . . . 0.0 110.931 177.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -153.83 -14.66 0.14 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.62 170.76 7.21 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 118.353 0.524 . . . . 0.0 111.457 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 44.5 tp -149.72 160.62 43.38 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.328 0.651 . . . . 0.0 109.318 179.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -146.09 173.86 11.81 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.024 0.93 . . . . 0.0 109.803 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 48.7 tp -152.53 157.71 41.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 13.9 p -152.24 141.15 14.0 Favored Pre-proline 0 CA--C 1.53 0.211 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -72.68 169.87 20.88 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.323 2.682 . . . . 0.0 111.31 178.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 . . . . . 0 CA--C 1.534 0.332 0 C-N-CA 125.479 1.511 . . . . 0.0 112.647 -179.996 . . . . . . . . 0 0 . 1 stop_ save_